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150-83-4 | Butanoic acid, 3-hydroxy-, sodium salt (1:1)
CAS No: 150-83-4 Catalog No: AG001M80 MDL No:MFCD00016716
Product Description
Catalog Number:
AG001M80
Chemical Name:
Butanoic acid, 3-hydroxy-, sodium salt (1:1)
CAS Number:
150-83-4
Molecular Formula:
C4H7NaO3
Molecular Weight:
126.0864
MDL Number:
MFCD00016716
IUPAC Name:
sodium;3-hydroxybutanoate
InChI:
InChI=1S/C4H8O3.Na/c1-3(5)2-4(6)7;/h3,5H,2H2,1H3,(H,6,7);/q;+1/p-1
InChI Key:
NBPUSGBJDWCHKC-UHFFFAOYSA-M
SMILES:
[O-]C(=O)CC(O)C.[Na+]
EC Number:
205-774-5
Properties
Complexity:
73.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.029g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
126.087g/mol
Monoisotopic Mass:
126.029g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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