Cas no 56475-82-2 (Carbamic acid, methyl(phenylmethyl)-, methyl ester)
56475-82-2 structure
Product Name:Carbamic acid, methyl(phenylmethyl)-, methyl ester
CAS No:56475-82-2
MF:C10H13NO2
MW:179.215722799301
CID:348787
PubChem ID:11008509
Update Time:2025-04-19
Carbamic acid, methyl(phenylmethyl)-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Carbamic acid, methyl(phenylmethyl)-, methyl ester
- methyl N-benzyl-N-methylcarbamate
- SCHEMBL2095210
- DTXSID00451659
- 56475-82-2
-
- Inchi： 1S/C10H13NO2/c1-11(10(12)13-2)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
- InChI Key： PXEXCTZPRFTKBZ-UHFFFAOYSA-N
- SMILES： O(C)C(N(C)CC1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 179.09469
- Monoisotopic Mass: 179.094628657g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 164
- 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: 1.6
- Topological Polar Surface Area: 29.5?2
Experimental Properties
- PSA: 29.54
Carbamic acid, methyl(phenylmethyl)-, methyl ester Related Literature
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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3. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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