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65427-54-5 | DL-2,4-Diaminobutyric acid dihydrochloride
CAS No: 65427-54-5 Catalog No: AG0034SK MDL No:MFCD00012910
Product Description
Catalog Number:
AG0034SK
Chemical Name:
DL-2,4-Diaminobutyric acid dihydrochloride
CAS Number:
65427-54-5
Molecular Formula:
C4H12Cl2N2O2
Molecular Weight:
191.0563
MDL Number:
MFCD00012910
IUPAC Name:
2,4-diaminobutanoic acid;dihydrochloride
InChI:
InChI=1S/C4H10N2O2.2ClH/c5-2-1-3(6)4(7)8;;/h3H,1-2,5-6H2,(H,7,8);2*1H
InChI Key:
CKAAWCHIBBNLOJ-UHFFFAOYSA-N
SMILES:
NCCC(C(=O)O)N.Cl.Cl
Properties
Complexity:
84.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.028g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
191.052g/mol
Monoisotopic Mass:
190.028g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
89.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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