Cas no 105687-75-0 (Carbamic acid, (3,5-dichlorophenyl)-)
105687-75-0 structure
Product Name:Carbamic acid, (3,5-dichlorophenyl)-
CAS No:105687-75-0
MF:C7H5Cl2NO2
MW:206.026099920273
CID:1162494
PubChem ID:678523
Update Time:2025-04-20
Carbamic acid, (3,5-dichlorophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Carbamic acid, (3,5-dichlorophenyl)-
- (3,5-dichlorophenyl)carbamic acid
- 105687-75-0
- TimTec1_001735
- HMS1538O19
- N-(3,5-dichlorophenyl)hydroxyamide
- SCHEMBL711831
- NCGC00174119-01
- DTXSID20350413
-
- Inchi： 1S/C7H5Cl2NO2/c8-4-1-5(9)3-6(2-4)10-7(11)12/h1-3,10H,(H,11,12)
- InChI Key： OMJLGCDQPXRIHT-UHFFFAOYSA-N
- SMILES： ClC1C=C(C=C(C=1)NC(=O)O)Cl
Computed Properties
- Exact Mass: 204.9697338g/mol
- Monoisotopic Mass: 204.9697338g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 167
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.2
- Topological Polar Surface Area: 49.3?2
Experimental Properties
- PSA: 49.33000
- LogP: 3.15630
Carbamic acid, (3,5-dichlorophenyl)- Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
-
Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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