Cas no 13386-35-1 (Benzenemethanol, 5-chloro-2-(methylamino)-a-phenyl-)
13386-35-1 structure
Product Name:Benzenemethanol, 5-chloro-2-(methylamino)-a-phenyl-
CAS No:13386-35-1
MF:C14H14ClNO
MW:247.720062732697
CID:1234022
PubChem ID:2853623
Update Time:2025-04-20
Benzenemethanol, 5-chloro-2-(methylamino)-a-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzenemethanol, 5-chloro-2-(methylamino)-a-phenyl-
- SR-01000214001
- SCHEMBL10976262
- CBMicro_024970
- CCG-12135
- [5-chloro-2-(methylamino)phenyl]-phenylmethanol
- [5-chloro-2-(methylamino)phenyl](phenyl)methanol
- DB-189788
- BIM-0025077.P001
- SR-01000214001-1
- (5-Chloro-2-(methylamino)phenyl)(phenyl)methanol
- Oprea1_810056
- 13386-35-1
-
- Inchi： 1S/C14H14ClNO/c1-16-13-8-7-11(15)9-12(13)14(17)10-5-3-2-4-6-10/h2-9,14,16-17H,1H3
- InChI Key： ZPUSFOHQVMOPOT-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=C(C=1)C(C1C=CC=CC=1)O)NC
Computed Properties
- Exact Mass: 247.07652
- Monoisotopic Mass: 247.0763918g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 230
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.9
- Topological Polar Surface Area: 32.3?2
Experimental Properties
- PSA: 32.26
Benzenemethanol, 5-chloro-2-(methylamino)-a-phenyl- Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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