tert-butyl 4,5-diaminopentanoate

tert-butyl 4,5-diaminopentanoate

CAS: 878799-20-3

Formula: C9H20N2O2

SMILES: CC(C)(C)OC(=O)CCC(N)CN

IUPAC: tert-butyl 4,5-diaminopentanoate

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

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	3
Hydrogen Bond Donor Count	2
InChIKey	RWCONZWLVFNJLR-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.65
Topological Polar Surface Area	78.34
Polarizability	21.12
Ring Count	0
Rotatable Bond Count	6

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