Cas no 51170-56-0 (N,n-diethylcarbamic acid benzyl ester)
51170-56-0 structure
Product Name:N,n-diethylcarbamic acid benzyl ester
CAS No:51170-56-0
MF:C12H17NO2
MW:207.268883466721
CID:2188222
PubChem ID:10262437
Update Time:2025-04-21
N,n-diethylcarbamic acid benzyl ester Chemical and Physical Properties
Names and Identifiers
-
- N,n-diethylcarbamic acid benzyl ester
- benzyl N,N-diethylcarbamate
- CHEMBL5440755
- Benzyl diethylcarbamate
- DTXSID50437504
- 51170-56-0
- SCHEMBL16665613
-
- Inchi： 1S/C12H17NO2/c1-3-13(4-2)12(14)15-10-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3
- InChI Key： AYEFZRJHKJIURZ-UHFFFAOYSA-N
- SMILES： O(CC1C=CC=CC=1)C(N(CC)CC)=O
Computed Properties
- Exact Mass: 207.125928785Da
- Monoisotopic Mass: 207.125928785Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 184
- 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: 2.9
- Topological Polar Surface Area: 29.5?2
N,n-diethylcarbamic acid benzyl ester Related Literature
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
-
Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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