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1638767-25-5 | Carbamic acid, N-(3-aminobicyclo[1.1.1]pent-1-yl)-, 1,1-dimethylethyl ester
CAS No: 1638767-25-5 Catalog No: AG001UI0 MDL No:MFCD27987307
Product Description
Catalog Number:
AG001UI0
Chemical Name:
Carbamic acid, N-(3-aminobicyclo[1.1.1]pent-1-yl)-, 1,1-dimethylethyl ester
CAS Number:
1638767-25-5
Molecular Formula:
C10H18N2O2
Molecular Weight:
198.2621
MDL Number:
MFCD27987307
IUPAC Name:
tert-butyl N-(3-amino-1-bicyclo[1.1.1]pentanyl)carbamate
InChI:
InChI=1S/C10H18N2O2/c1-8(2,3)14-7(13)12-10-4-9(11,5-10)6-10/h4-6,11H2,1-3H3,(H,12,13)
InChI Key:
WDWZFRPJPZEOBM-UHFFFAOYSA-N
SMILES:
O=C(NC12CC(C1)(C2)N)OC(C)(C)C
Properties
Complexity:
261
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:
2
Isotope Atom Count:
0
Molecular Weight:
198.266g/mol
Monoisotopic Mass:
198.137g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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