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120157-98-4 | Carbamic acid, N-acetyl-, 1,1-dimethylethyl ester
CAS No: 120157-98-4 Catalog No: AG000QF1 MDL No:MFCD11977691
Product Description
Catalog Number:
AG000QF1
Chemical Name:
Carbamic acid, N-acetyl-, 1,1-dimethylethyl ester
CAS Number:
120157-98-4
Molecular Formula:
C7H13NO3
Molecular Weight:
159.1830
MDL Number:
MFCD11977691
IUPAC Name:
tert-butyl N-acetylcarbamate
InChI:
InChI=1S/C7H13NO3/c1-5(9)8-6(10)11-7(2,3)4/h1-4H3,(H,8,9,10)
InChI Key:
WUPPVCVLOXKYBQ-UHFFFAOYSA-N
SMILES:
CC(=O)NC(=O)OC(C)(C)C
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.09g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
159.185g/mol
Monoisotopic Mass:
159.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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