2,4-diaminobutanoic acid dihydrochloride

2,4-diaminobutanoic acid dihydrochloride

CAS: 65427-54-5

Formula: C4H12Cl2N2O2

SMILES: Cl.Cl.NCCC(N)C(O)=O

IUPAC: 2,4-diaminobutanoic acid dihydrochloride

InChI: InChI=1/C4H10N2O2.2ClH/c5-2-1-3(6)4(7)8;;/h3H,1-2,5-6H2,(H,7,8);2*1H

Composition: C (25.15%), H (6.33%), Cl (37.11%), N (14.66%), O (16.75%)

Molar Mass: 191.05

Atom Count: 22

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	190.027583
Formal Charge	0
FSP3	0.75
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
InChIKey	CKAAWCHIBBNLOJ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	28.56
Topological Polar Surface Area	89.34
Polarizability	11.71
Ring Count	0
Rotatable Bond Count	3

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