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156892-82-9 | Carbamic acid, N-(2-amino-2-methylpropyl)-, phenylmethyl ester
CAS No: 156892-82-9 Catalog No: AG001P1U MDL No:MFCD11041339
Product Description
Catalog Number:
AG001P1U
Chemical Name:
Carbamic acid, N-(2-amino-2-methylpropyl)-, phenylmethyl ester
CAS Number:
156892-82-9
Molecular Formula:
C12H18N2O2
Molecular Weight:
222.2835
MDL Number:
MFCD11041339
IUPAC Name:
benzyl N-(2-amino-2-methylpropyl)carbamate
InChI:
InChI=1S/C12H18N2O2/c1-12(2,13)9-14-11(15)16-8-10-6-4-3-5-7-10/h3-7H,8-9,13H2,1-2H3,(H,14,15)
InChI Key:
YOQCQUOSSVXHLD-UHFFFAOYSA-N
SMILES:
O=C(NCC(N)(C)C)OCc1ccccc1
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.137g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
222.288g/mol
Monoisotopic Mass:
222.137g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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