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1630906-49-8 | Carbamic acid, N-[(3-aminobicyclo[1.1.1]pent-1-yl)methyl]-, 1,1-dimethylethyl ester
CAS No: 1630906-49-8 Catalog No: AG001TP4 MDL No:MFCD27987306
Product Description
Catalog Number:
AG001TP4
Chemical Name:
Carbamic acid, N-[(3-aminobicyclo[1.1.1]pent-1-yl)methyl]-, 1,1-dimethylethyl ester
CAS Number:
1630906-49-8
Molecular Formula:
C11H20N2O2
Molecular Weight:
212.2887
MDL Number:
MFCD27987306
IUPAC Name:
tert-butyl N-[(3-amino-1-bicyclo[1.1.1]pentanyl)methyl]carbamate
InChI:
InChI=1S/C11H20N2O2/c1-9(2,3)15-8(14)13-7-10-4-11(12,5-10)6-10/h4-7,12H2,1-3H3,(H,13,14)
InChI Key:
TXIPPSCTYAERAQ-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCC12CC(C1)(C2)N
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.152g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
212.293g/mol
Monoisotopic Mass:
212.152g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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