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71203-19-5 | CHOLINE MALEIC HYDRAZIDE
CAS No: 71203-19-5 Catalog No: AG005KCJ MDL No:
Product Description
Catalog Number:
AG005KCJ
Chemical Name:
CHOLINE MALEIC HYDRAZIDE
CAS Number:
71203-19-5
Molecular Formula:
C9H20N3O4+
Molecular Weight:
234.2728
IUPAC Name:
4-hydrazinyl-4-oxobut-2-enoic acid;2-hydroxyethyl(trimethyl)azanium
InChI:
InChI=1S/C5H14NO.C4H6N2O3/c1-6(2,3)4-5-7;5-6-3(7)1-2-4(8)9/h7H,4-5H2,1-3H3;1-2H,5H2,(H,6,7)(H,8,9)/q+1;
InChI Key:
AIOUZLSKGYTLCA-UHFFFAOYSA-N
SMILES:
NNC(=O)/C=C\C(=O)O.OCC[N+](C)(C)C
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.145g/mol
Formal Charge:
1
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
234.276g/mol
Monoisotopic Mass:
234.145g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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