Browse
Submit Data
Databases
API
Help

Dataset Information

0 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

N-(2,4,6-Trimethyl-phen-yl)succinamic acid.

ABSTRACT: The amide bond in the title compound {systematic name: 3-[(2,4,6-trimethyl-phen-yl)amino-carbon-yl]propionic acid}, C(13)H(17)NO(3), has a trans conformation. In the crystal, two mol-ecules form a centrosymmetric dimer connected by pairs of O-H?O hydrogen bonds. Inter-molecular N-H?O hydrogen bonds link the dimers into a three dimensional network.

SUBMITTER: Gowda BT

PROVIDER: S-EPMC2977192 | biostudies-literature | 2009 Jul

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

N-(2,4,6-Trimethyl-phen-yl)succinamic acid.

Gowda B Thimme BT Foro Sabine S Saraswathi B S BS Fuess Hartmut H

Acta crystallographica. Section E, Structure reports online 20090731 Pt 8

The amide bond in the title compound {systematic name: 3-[(2,4,6-trimethyl-phen-yl)amino-carbon-yl]propionic acid}, C(13)H(17)NO(3), has a trans conformation. In the crystal, two mol-ecules form a centrosymmetric dimer connected by pairs of O-H⋯O hydrogen bonds. Inter-molecular N-H⋯O hydrogen bonds link the dimers into a three dimensional network. ...[more]

PMID: 21583718

Similar Datasets

N-(2,4,6-Trimethyl-phen-yl)maleamic acid.

Project description:The mol-ecular structure of the title compound, C(13)H(15)NO(3), is stabilized by a short intra-molecular O-H?O hydrogen bond within the maleamic unit. In the crystal, inter-molecular N-H?O hydrogen bonds link mol-ecules into zigzag chains propagating in [010].

| S-EPMC2971101 | biostudies-literature

N-(2,4,6-Trimethyl-phen-yl)formamide.

Project description:The title compound, C(10)H(13)NO, was obtained as the unexpected, almost exclusive, product in the attempted synthesis of a manganese(I)-N-heterocyclic carbene (NHC) complex. The dihedral angle between the planes of the formamide moiety and the aryl ring is 68.06?(10)°. In the crystal, mol-ecules are linked by N-H?O hydrogen bonds, forming infinite chains along the c axis.

| S-EPMC3050174 | biostudies-literature

[2,7-Dimeth-oxy-8-(2,4,6-trimethyl-benzo-yl)naphthalen-1-yl](2,4,6-trimethyl-phen-yl)methanone.

Project description:In the title compound, C(32)H(32)O(4), the dihedral angle between the two benzene rings of the 2,4,6-trimethyl-benzoyl groups is 71.43?(7)°. The dihedral angles between the two benzene rings and the naphthalene ring system are 81.58?(5) and 84.92?(6)°. An intra-molecular C-H?O inter-action is observed.

| S-EPMC3254363 | biostudies-literature

(2,4,6-Trimethyl-phen-yl)boronic acid-triphenyl-phosphine oxide (1/1).

Project description:In the crystal structure of the title compound, C(9)H(13)BO(2)·C(18)H(15)OP, there are O-H?O hydrogen bonds between the O atom of triphenyl-phosphine oxide and one hy-droxy group of the boronic acid. Boronic acid mol-ecules form inversion-related hydrogen-bonded dimers in an R(2) (2)(8) motif. The structure is consolidated by inter-molecular C-H?O bonds and C-H?? inter-actions.

| S-EPMC3254394 | biostudies-literature

Bis(2,4,6-trimethyl-phen-yl)zinc(II).

Project description:The title compound, [Zn(C(9)H(11))(2)] or Mes(2)Zn (Mes = mesityl = 2,4,6-trimethyl-phen-yl), crystallizes with a quarter of a mol-ecule in the asymmetric unit. The Zn(II) atom is in a strictly linear environment with a Zn-C bond length of 1.951?(5)?Å. Due to the imposed 2/m symmetry, both aromatic rings are coplanar. One of the methyl groups is disordered over two equally occupied positions.

| S-EPMC2969329 | biostudies-literature

2-(2,4,6-Trimethyl-phen-yl)-1,10-phenanthroline.

Project description:In the title mol-ecule, C(21)H(18)N(2), the mean plane of the benzene ring of the mesityl group forms a dihedral angle of 82.69 (4)° with that of the phenanthroline ring system. The crystal structure is stabilized by π-π stacking inter-actions between the phenanthroline system and the benzene ring of the mesityl group of a symmetry-related mol-ecule, with centroid-centroid distances of 3.7776 (14) and 3.7155 (13) Å.

| S-EPMC2968955 | biostudies-literature

(2,4,6-Trimethyl-phen-yl){2-[N-(2,4,6-trimethyl-phen-yl)formamido]-eth-yl}ammonium chloride.

Project description:In the title salt, C21H29N2O(+)·Cl(-), the benzene rings form a dihedral angle of 6.13?(1)°. In the crystal, N-H?Cl hydrogen bonds link the cations and anions into chains extending along the c axis.

| S-EPMC3588815 | biostudies-other

1-(3-Ammonio-methyl-2,4,6-trimethyl-benz-yl)-3-(2,4,6-trimethyl-phen-yl)imidazol-1-ium dibromide monohydrate.

Project description:In the title compound, C(25)H(35)N(3) (2+)·2Br(-)·H(2)O, the dihedral angles between the imidazole ring and the two outer benzene rings are 80.16?(16) and 69.40?(18)°. The component species are linked by N-H?Br, O-H?Br and C-H?Br hydrogen bonds.

| S-EPMC2977708 | biostudies-literature

2-[6-Thioxo-5-(2,4,6-trimethyl-phen-yl)-1,3,5-thia-diazinan-3-yl]acetic acid.

Project description:In the mol-ecule of the title compound, C(14)H(18)N(2)O(2)S(2), the 1,3,5-thia-diazinane-2-thione ring adopts an envelope conformation with one of the N atoms at the flap position. The plane throught the five co-planar atoms of the heterocycle is oriented at a dihedral angle of 80.59 (8)° with respect to the aromatic ring. In the crystal structure, weak inter-molecular O-H⋯S inter-actions link the mol-ecules into chains along the b axis.

| S-EPMC2968990 | biostudies-literature

N-(3,5-Dimethyl-phen-yl)succinamic acid.

Project description:In the title compound, C(12)H(15)NO(3), the N-H and C=O bonds are anti to each other. The C=O and O-H bonds of the acid group display an anti-periplanar orientation relative to each other. The crystal packing features a three-dimensional network of molecules held together by O-H?O and N-H?O hydrogen bonds.

| S-EPMC3050227 | biostudies-literature

OmicsDI is part of the ELIXIR infrastructure

OmicsDI is an Elixir interoperability service. Learn more ›

Tweets

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