tert-butyl N-(3-aminobutyl)carbamate

tert-butyl N-(3-aminobutyl)carbamate

CAS: 878799-20-3

Formula: C9H20N2O2

SMILES: CC(N)CCNC(=O)OC(C)(C)C

IUPAC: tert-butyl N-(3-aminobutyl)carbamate

InChI: InChI=1/C9H20N2O2/c1-7(10)5-6-11-8(12)13-9(2,3)4/h7H,5-6,10H2,1-4H3,(H,11,12)

Composition: C (57.42%), H (10.71%), N (14.88%), O (17.00%)

Molar Mass: 188.271

Atom Count: 33

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	188.152477892
Formal Charge	0
FSP3	0.89
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	MSCLVLGMLLYXFV-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.03
Topological Polar Surface Area	64.35
Polarizability	20.74
Ring Count	0
Rotatable Bond Count	5

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