Unknown

Dataset Information

0

Methyl 3-[4-(4-nitro-benz-yloxy)phen-yl]propano-ate.

ABSTRACT: The title compound, C(17)H(17)NO(5), crystallizes with two mol-ecules (A and B) in the asymmetric unit. The conformational structures of the two mol-ecules show small but significant differences in the dihedral angles between the two aryl rings with values of 18.8?(1)° for mol-ecule A and 7.5?(1)° for mol-ecule B. In mol-ecule A, the propano-ate group is twisted out of the plane of the benzene group [C(ar)-C(ar)-C-C torsion angle = -44.9?(2)°], while for mol-ecule B, this group lies closer to the plane [C(ar)-C(ar)-C-C torsion angle = 8.6?(3)°]. C-H?O inter-actions characterize the crystal-packing inter-actions in this compound.

SUBMITTER: Servinis L 

PROVIDER: S-EPMC3393271 | biostudies-literature | 2012 Jul

REPOSITORIES: biostudies-literature

Json Xml
altmetric image

Publications

Methyl 3-[4-(4-nitro-benz-yloxy)phen-yl]propano-ate.

Servinis Linden L   Fox Bronwyn L BL   Healy Peter C PC   Henderson Luke C LC  

Acta crystallographica. Section E, Structure reports online 20120602 Pt 7

The title compound, C(17)H(17)NO(5), crystallizes with two mol-ecules (A and B) in the asymmetric unit. The conformational structures of the two mol-ecules show small but significant differences in the dihedral angles between the two aryl rings with values of 18.8 (1)° for mol-ecule A and 7.5 (1)° for mol-ecule B. In mol-ecule A, the propano-ate group is twisted out of the plane of the benzene group [C(ar)-C(ar)-C-C torsion angle = -44.9 (2)°], while for mol-ecule B, this group lies closer to th  ...[more]

Similar Datasets

Unknown N-(2-Chloro-phen-yl)-1-phenyl-formamido 3-(2-nitro-phen-yl)propano-ate.
| S-EPMC3470253 | biostudies-literature
Unknown 1-[(3-Benz-yloxy-2-nitro-phen-oxy)meth-yl]benzene.
| S-EPMC3414184 | biostudies-literature
Unknown 1-(4-Benz-yloxy-5-meth-oxy-2-nitro-phen-yl)ethanone.
| S-EPMC2977694 | biostudies-literature
Unknown Methyl 2-[4-(4-chloro-benzo-yl)phen-oxy]-2-methyl-propano-ate.
| S-EPMC3379272 | biostudies-literature
Unknown (S)-Methyl 2-benzamido-3-(3,4-dimeth-oxy-phen-yl)propano-ate.
| S-EPMC3254516 | biostudies-literature
Unknown Methyl 2-{[(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl-idene)(4-nitro-phen-yl)meth-yl]amino}-3-phenyl-propano-ate.
| S-EPMC3344020 | biostudies-literature
Unknown Crystal structure of (E)-5-benz-yloxy-2-{[(4-nitro-phen-yl)imino]-meth-yl}phenol.
| S-EPMC4719944 | biostudies-literature
Unknown Ethyl 2-[4-(4-chloro-benzo-yl)phen-oxy]-2-methyl-propano-ate.
| S-EPMC3379337 | biostudies-literature
Unknown [3,5-Bis(benz-yloxy)phen-yl]methanol.
| S-EPMC2977662 | biostudies-literature
Unknown 4-Nitro-phenyl 2-bromo-2-methyl-propano-ate.
| S-EPMC3051967 | biostudies-literature