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1378608-46-8 | Carbamic acid, N-(2-cyano-1,1-dimethylethyl)-, 1,1-dimethylethyl ester
CAS No: 1378608-46-8 Catalog No: AG0013YN MDL No:MFCD18252885
Product Description
Catalog Number:
AG0013YN
Chemical Name:
Carbamic acid, N-(2-cyano-1,1-dimethylethyl)-, 1,1-dimethylethyl ester
CAS Number:
1378608-46-8
Molecular Formula:
C10H18N2O2
Molecular Weight:
198.2621
MDL Number:
MFCD18252885
IUPAC Name:
tert-butyl N-(1-cyano-2-methylpropan-2-yl)carbamate
InChI:
InChI=1S/C10H18N2O2/c1-9(2,3)14-8(13)12-10(4,5)6-7-11/h6H2,1-5H3,(H,12,13)
InChI Key:
RSILEIAGEFITEE-UHFFFAOYSA-N
SMILES:
N#CCC(NC(=O)OC(C)(C)C)(C)C
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.137g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.266g/mol
Monoisotopic Mass:
198.137g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
62.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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