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15574-09-1 | Butanedioic acid, ammonium salt (1:?)
CAS No: 15574-09-1 Catalog No: AG001O5N MDL No:MFCD00020534
Product Description
Catalog Number:
AG001O5N
Chemical Name:
Butanedioic acid, ammonium salt (1:?)
CAS Number:
15574-09-1
Molecular Formula:
C4H9NO4
Molecular Weight:
135.1186
MDL Number:
MFCD00020534
IUPAC Name:
diazanium;butanedioate
InChI:
InChI=1S/C4H6O4.2H3N/c5-3(6)1-2-4(7)8;;/h1-2H2,(H,5,6)(H,7,8);2*1H3
InChI Key:
NHJPVZLSLOHJDM-UHFFFAOYSA-N
SMILES:
[O-]C(=O)CCC(=O)O.[NH4+]
UNII:
DTZ9PEC9JL
Properties
Complexity:
81.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.08g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
152.15g/mol
Monoisotopic Mass:
152.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
82.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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