Home Aminos Carbamic acid, [1-(aminomethyl)propyl]-, 1,1-dimethylethyl ester (9CI)

Carbamic acid, [1-(aminomethyl)propyl]-, 1,1-dimethylethyl ester (9CI)

CAS No.:
732219-83-9
Catalog Number:
AG00FKZC
Molecular Formula:
C9H20N2O2
Molecular Weight:
188.2673
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Product Description
Catalog Number:
AG00FKZC
Chemical Name:
Carbamic acid, [1-(aminomethyl)propyl]-, 1,1-dimethylethyl ester (9CI)
CAS Number:
732219-83-9
Molecular Formula:
C9H20N2O2
Molecular Weight:
188.2673
MDL Number:
MFCD16660180
IUPAC Name:
tert-butyl N-(1-aminobutan-2-yl)carbamate
InChI:
InChI=1S/C9H20N2O2/c1-5-7(6-10)11-8(12)13-9(2,3)4/h7H,5-6,10H2,1-4H3,(H,11,12)
InChI Key:
KGJCYTMWAXWVOM-UHFFFAOYSA-N
SMILES:
CCC(NC(=O)OC(C)(C)C)CN
Properties
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.152g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
188.271g/mol
Monoisotopic Mass:
188.152g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties