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2-(2-Benzyl-phen-yl)propan-2-ol.

ABSTRACT: There are two mol-ecules in the asymmetric unit of the title compound, C(16)H(18)O, a tertiary alcohol featuring a 2-benzyl-phenyl substituent. Co-operative O-H⋯O hydrogen bonds connect the mol-ecules into tetra-mers.

SUBMITTER: Betz R

PROVIDER: S-EPMC3238955 | biostudies-literature |

REPOSITORIES: biostudies-literature

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2-(5-Bromo-2-methyl-phen-yl)propan-2-ol.

Project description:The title compound, C(10)H(13)BrO, crystallizes with four independent mol-ecules of similar geometry in the asymmetric unit. The crystal packing is stabilized by inter-molecular O-H?O hydrogen bonds, which link the mol-ecules into tetra-mers.

| S-EPMC3009192 | biostudies-literature

2-(4-Methyl-phen-yl)-1-(phenyl-sulfon-yl)propan-2-ol.

Project description:The title compound, C(16)H(18)O(3)S, features a U-shape mol-ecular structure with a dihedral angle between the terminal benzene rings of 20.8?(1)°. An intra-molecular O-H?O hydrogen bond helps to stabilize the mol-ecular structure. Inter-molecular classical O-H?O and weak C-H?O hydrogen bonding is present in the crystal structure.

| S-EPMC3247583 | biostudies-literature

1-(Piperidin-1-yl)-3-(2,4,6-trimethyl-phen-yl)propan-2-ol.

Project description:The title compound, C(17)H(27)NO, features a bufferfly-shaped substituted 2-propanol having an aromatic ring on the 1-carbon and a piperidine ring on the 3-carbon. The piperidine ring adopts a chair conformation and its N atom shows a trigonal coordination. In the crystal, the hy-droxy group inter-acts with the N atom of an inversion-related mol-ecule, generating an O-H⋯N hydrogen-bonded dimer.

| S-EPMC3052162 | biostudies-literature

2-(Adamantan-1-yl)-1,3-bis-(4-methyl-phen-yl)propan-2-ol.

Project description:The conformation of the title compound, C27H34O, is stabilized by a weak intra-molecular C-H?? inter-action. The dihedral angle between the benzene rings is 54.79?(4)°. The adamantane cage consists of three fused cyclo-hexane rings in classical chair conformations, with C-C-C angles in the range 107.75?(10)-111.35?(9)°. Although the mol-ecule contains a hy-droxy group as a conceivable hydrogen-bond donor, this group is sterically hindered by bulky substituents and no hydrogen bonds are observed in the crystal structure.

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1-Methyl-amino-3-(2,4,6-trimethyl-phen-yl)propan-2-ol.

Project description:The methyl-amino-propyl chain in the title compound, C(13)H(21)NO, adopts an extended zigzag conformation and the N atom shows a trigonal coordination. The N atom acts as hydrogen-bond acceptor to the hy-droxy group of an adjacent mol-ecule, generating a helical chain running along the b axis. The amino H atom is not involved in hydrogen bonding.

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2-(1H-Benzotriazol-1-yl)-3-(2,6-dichloro-phen-yl)-1-phenyl-propan-1-ol.

Project description:The asymmetric unit of the title compound, C(21)H(17)Cl(2)N(3)O, contains two crystallographically independent mol-ecules with similar conformations. The benzotriazole ring is oriented at dihedral angles of 30.61?(5) and 43.36?(5)°, respectively, to the phenyl and dichloro-phenyl rings in one mol-ecule, and 32.25?(5) and 41.04?(5)° in the other. The dihedral angles between the phenyl and dichloro-phenyl rings are 66.38?(7) and 66.14?(6)° in the two mol-ecules. An intra-molecular O-H?N hydrogen bond links the benzotriazole ring and phenyl-propanol unit in each mol-ecule. In the crystal, weak inter-molecular C-H?N hydrogen bonds link the mol-ecules into chains along the a axis. ?-? stacking between the dichloro-phenyl rings [centroid-centroid distances = 3.809?(1) and 3.735?(1)?Å] may further stabilize the crystal structure.

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2-[2-(2-Nitro-phen-yl)-4,5-diphenyl-1H-imidazol-1-yl]-3-phenyl-propan-1-ol.

Project description:In the title compound, C30H25N3O3, the central imidazole ring forms dihedral angles of 77.34?(6), 12.56?(6) and 87.04?(6)°, respectively, with the o-nitro-benzene ring and the phenyl substituents in the 5- and 4-positions. The mol-ecular conformation is stabilized by weak intra-molecular C-H?? inter-actions. In the crystal, mol-ecules are linked by O-H?N hydrogen bonds, forming chains running parallel to the b-axis direction.

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Benzyl N-{2-[5-(4-chloro-phen-yl)-1,2,4-oxadiazol-3-yl]propan-2-yl}carbamate.

Project description:In the title 1,2,4-oxadiazole derivative, C(19)H(18)ClN(3)O(3), the 1,2,4-oxadiazole ring makes dihedral angles of 12.83?(8) and 4.89?(8)°, respectively, with the benzyl and 4-chloro-phenyl rings, while the dihedral angle between the benzyl and 4-chloro-phenyl rings is 11.53?(7)°. In the crystal, mol-ecules are linked by N-H?N hydrogen bonds into helical chains along the b axis. A weak C-H?? inter-action is also present.

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2-(Biphenyl-4-yl)propan-2-ol.

Project description:The title compound, C(15)H(16)O, crystallizes with two independent mol-ecules in the asymmetric unit. Due to the space-group symmetry, this results in the formation of a tetra-mer where the four mol-ecules are connected by O-H?O hydrogen bonds. The mol-ecules pack parallel to the c axis. Both mol-ecules in the asymmetric unit are nonplanar and the dihedral angles between connected aromatic rings in each mol-ecule are 7.96?(12) and 9.75?(13)°. This contrasts with the gas phase density functional theory (DFT) optimized conformation, where this dihedral angle is 39.33°.

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2-[Bis(3,5-dimethyl-phen-yl)-phosphor-yl]-propan-2-ol hemihydrate.

Project description:In the organic mol-ecule of the title compound, C(19)H(25)O(2)P·0.5H(2)O, the benzene rings are oriented at a dihedral angle of 54.04?(3)°. Intra-molecular C-H?O hydrogen bonds result in the formation of two five-membered planar rings, which are oriented with respect to the adjacent benzene rings at dihedral angles of 2.66?(3) and 2.79?(3)°. In the crystal structure, inter-molecular O-H?O hydrogen bonds link the mol-ecules. The water oxygen atom lies on a twofold rotation axis.

| S-EPMC2961830 | biostudies-other

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