Browse
Submit Data
Databases
API
Help

Dataset Information

3 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

4-Benz-yloxy-2-bromo-1-meth-oxy-benzene.

ABSTRACT: In the title compound, C(14)H(13)BrO(2), the phenyl ring is oriented at a dihedral angle of 72.6?(3)° with respect to the bromo-meth-oxy-phenyl ring. The crystal structure is stabilized by weak inter-molecular C-H?O inter-actions.

SUBMITTER: Huang X

PROVIDER: S-EPMC3200816 | biostudies-other | 2011 Sep

REPOSITORIES: biostudies-other

ACCESS DATA

Json Xml

Publications

4-Benz-yloxy-2-bromo-1-meth-oxy-benzene.

Huang Xing X Ren Li-Hong LH Yin Rong-Hua RH Gao Feng F

Acta crystallographica. Section E, Structure reports online 20110811 Pt 9

In the title compound, C(14)H(13)BrO(2), the phenyl ring is oriented at a dihedral angle of 72.6 (3)° with respect to the bromo-meth-oxy-phenyl ring. The crystal structure is stabilized by weak inter-molecular C-H⋯O inter-actions. ...[more]

PMID: 22064789

Similar Datasets

1-Benz-yloxy-2,5-bis-(chloro-meth-yl)-4-meth-oxy-benzene.

Project description:In the title compound, C(16)H(16)Cl(2)O(2), the dihedral angle between the two rings is 52.65?(10)°. The two Cl atoms are trans to one another being displaced by 1.644?(5) and -1.664?(4)?Å from the plane of the benzene ring. Except for the two Cl atoms and the C atoms of the ring of the benz-yloxy group, all the other atoms of the compound lie in the same plane [maximum deviation = 0.056?(3)?Å]. In the crystal, no significant intermolecular interactions are observed.

| S-EPMC3414275 | biostudies-literature

1-[(3-Benz-yloxy-2-nitro-phen-oxy)meth-yl]benzene.

Project description:The asymmetric unit of the title compound, C(20)H(17)NO(4), consists of two crystallographically independent mol-ecules. In one of the mol-ecules, the central benzene ring forms dihedral angles of 2.26?(6) and 58.68?(6)° with the terminal benzene rings and the dihedral angle between the terminal benzene rings is 56.45?(6)°. The corresponding values for the other mol-ecule are 35.17?(6), 70.97?(6) and 69.62?(6)°, respectively. In the crystal, an inversion dimer linked by a pair of C-H?O hydrogen bonds occurs for one of the unique mol-ecules. C-H?? and ?-? [centroid-centroid distances = 3.7113?(8) and 3.7216?(7)?Å] inter-actions link the components into a three-dimensional network.

| S-EPMC3414184 | biostudies-literature

4-(Benz-yloxy)phenyl 4-hexa-dec-yloxy-3-meth-oxy-benzoate.

Project description:In the title compound, C(37)H(50)O(5), the central benzene ring makes dihedral angles of 39.72?(14) and 64.43?(13)° with the benzyl and 3-meth-oxy-benzoate rings, respectively. The crystal structure is stabilized by inter-molecular C-H?? inter-actions involving the central benzene ring and the benzene ring closest to the aliphatic chain.

| S-EPMC3100024 | biostudies-literature

Methyl 4-(benz-yloxy)-3-meth-oxy-benzo-ate.

Project description:In the title compound, C16H16O4, the aromatic rings are almost normal to one another, making a dihedral angle of 85.81?(10)°. In the crystal, mol-ecules are linked by C-H?O hydrogen bonds, forming chains propagating along the b-axis direction. There are also C-H?? inter-actions present which link the chains, forming two-dimensional networks lying parallel to (102).

| S-EPMC3790423 | biostudies-literature

4-[3-(Bromo-meth-yl)benz-yloxy]-3-methoxy-benzaldehyde.

Project description:In the title compound, C(16)H(15)BrO(3), the dihedral angle between the mean planes of the two benzene rings is 76.64?(2)°. In the crystal structure, there are weak ?-? stacking inter-actions, with a centroid-centroid distance of 3.724?(3)?Å, as well as an inter-molecular C?Br distance [3.495?(2)?Å] which is slightly less than the sum of the van der Waals radii for these atoms.

| S-EPMC2983760 | biostudies-literature

Ethyl ent-15?-[(2-meth-oxy-benz-yloxy)meth-yl]-16-oxobeyeran-20-oate.

Project description:The title compound, C(31)H(44)O(5), was synthesized from isostev-iol (systematic name: ent-16-ketobeyeran-19-oic acid). In the mol-ecule, the three six-membered rings adopt chair conformations and the stereochemistry of the A/B and B/C ring junctions are trans. The five-membered ring D adopts an envelope conformation with the methyl-ene C atom as the flap.

| S-EPMC3275241 | biostudies-literature

2-(2-{2-[2-(Dibromo-meth-yl)phen-oxy]eth-oxy}benz-yloxy)benzaldehyde.

Project description:The mol-ecule of the title compound, C(23)H(20)Br(2)O(4), adopts a Z conformation as a result of inter-molecular C-H?Br bonding. One benzene ring, with the structure R-CHBr(2), makes a dihedral angle of 63.0?(2)° with the other benzene ring attached to the aldehyde group. Inter-molecular ?-? stacking inter-actions [centroid-centroid distance = 3.698?(4)?Å] and a weak C-H?Br contact is present in the crystal structure.

| S-EPMC3052107 | biostudies-literature

1-(4-Benz-yloxy-5-meth-oxy-2-nitro-phen-yl)ethanone.

Project description:In the mol-ecule of the title compound, C(16)H(15)NO(5), the aromatic rings are oriented at a dihedral angle of 74.89?(3)°. Intra-molecular C-H?O inter-actions result in the formation of a seven-membered ring. In the crystal structure, weak inter-molecular C-H?O inter-actions link the mol-ecules into chains along the b axis.

| S-EPMC2977694 | biostudies-literature

1,3-Dibenz-yloxy-5-(bromo-meth-yl)benzene.

Project description:In the title compound, C(21)H(19)BrO(2), the dihedral angles between the central benzene ring and the two peripheral rings are 50.28?(5) and 69.75?(2)°. The O-CH(2) bonds lie in the plane of the central ring and adopt a syn-anti conformation.

| S-EPMC2968864 | biostudies-other

(2E)-Methyl 2-(7-benz-yloxy-1-naphth-yl)-3-meth-oxy-acrylate.

Project description:In the title compound, C(22)H(20)O(4), the dihedral angle between the phenyl and naphthalene ring systems is 86.10?(10)°. The methoxyacrylate group is disordered over two orientations in a 0.905?(3):0.095?(3) ratio.

| S-EPMC3007028 | biostudies-literature

OmicsDI is part of the ELIXIR infrastructure

OmicsDI is an Elixir interoperability service. Learn more ›

OmicsDI Databases

PRIDE
PeptideAtlas
MassIVE
JPOST Repository
Physiome Model Repository

EGA
EVA
ENA
LINCS
PAXDB
Cell Collective

MetaboLights
Metabolomics Workbench
MetabolomeExpress
GNPS
BioModels
FAIRDOMHub

ArrayExpress
dbGaP
ExpressionAtlas
GEO
NODE

Information

Databases
Help
API
Contact us
Code on GitHub
Terms of use
Submit Data