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1403767-13-4 | Carbamic acid, N-[(1-aminocyclobutyl)methyl]-, 1,1-dimethylethyl ester
CAS No: 1403767-13-4 Catalog No: AG001CAK MDL No:MFCD23106332
Product Description
Catalog Number:
AG001CAK
Chemical Name:
Carbamic acid, N-[(1-aminocyclobutyl)methyl]-, 1,1-dimethylethyl ester
CAS Number:
1403767-13-4
Molecular Formula:
C10H20N2O2
Molecular Weight:
200.2780
MDL Number:
MFCD23106332
IUPAC Name:
tert-butyl N-[(1-aminocyclobutyl)methyl]carbamate
InChI:
InChI=1S/C10H20N2O2/c1-9(2,3)14-8(13)12-7-10(11)5-4-6-10/h4-7,11H2,1-3H3,(H,12,13)
InChI Key:
WFPKQHOVCRLVAG-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCC1(N)CCC1
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.152g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
200.282g/mol
Monoisotopic Mass:
200.152g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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