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10047-90-2 | Carbamic acid, N-methyl-, 1-methylethyl ester
CAS No: 10047-90-2 Catalog No: AG00022I MDL No:MFCD19217071
Product Description
Catalog Number:
AG00022I
Chemical Name:
Carbamic acid, N-methyl-, 1-methylethyl ester
CAS Number:
10047-90-2
Molecular Formula:
C5H11NO2
Molecular Weight:
117.1463
MDL Number:
MFCD19217071
IUPAC Name:
propan-2-yl N-methylcarbamate
InChI:
InChI=1S/C5H11NO2/c1-4(2)8-5(7)6-3/h4H,1-3H3,(H,6,7)
InChI Key:
ZLQUUMARLOVRLO-UHFFFAOYSA-N
SMILES:
CNC(=O)OC(C)C
UNII:
34U424V9N2
NSC Number:
29183
Properties
Complexity:
80.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
117.079g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
117.148g/mol
Monoisotopic Mass:
117.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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