methyl (2R)-2,4-diaminobutanoate dihydrochloride

methyl (2R)-2,4-diaminobutanoate dihydrochloride

CAS: 2428386-82-5

Formula: C5H14Cl2N2O2

SMILES: Cl.Cl.COC(=O)[C@H](N)CCN

IUPAC: methyl (2R)-2,4-diaminobutanoate dihydrochloride

InChI: InChI=1S/C5H12N2O2.2ClH/c1-9-5(8)4(7)2-3-6;;/h4H,2-3,6-7H2,1H3;2*1H/t4-;;/m1../s1

Composition: C (29.28%), H (6.88%), Cl (34.57%), N (13.66%), O (15.60%)

Molar Mass: 205.08

Atom Count: 25

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	204.0432331
Formal Charge	0
FSP3	0.8
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	BGFZBYKHHGUPSG-RZFWHQLPSA-N
Lipinski's Rule of Five	1
Molar Refractivity	33.33
Topological Polar Surface Area	78.34
Polarizability	13.78
Ring Count	0
Rotatable Bond Count	4

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