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56279-37-9 | Sodium 4-hydroxypentanoate
CAS No: 56279-37-9 Catalog No: AG003AWW MDL No:MFCD28023743
Product Description
Catalog Number:
AG003AWW
Chemical Name:
Sodium 4-hydroxypentanoate
CAS Number:
56279-37-9
Molecular Formula:
C5H9NaO3
Molecular Weight:
140.1129
MDL Number:
MFCD28023743
IUPAC Name:
sodium;4-hydroxypentanoate
InChI:
InChI=1S/C5H10O3.Na/c1-4(6)2-3-5(7)8;/h4,6H,2-3H2,1H3,(H,7,8);/q;+1/p-1
InChI Key:
MEGFTCUCXBRUTB-UHFFFAOYSA-M
SMILES:
CC(CCC(=O)[O-])O.[Na+]
Properties
Complexity:
84.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.045g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
140.114g/mol
Monoisotopic Mass:
140.045g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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