Home Other Building Blocks sodium 4-(methylcarbamoyl)butanoate

sodium 4-(methylcarbamoyl)butanoate

CAS No.:
1443981-40-5
Catalog Number:
AG01A5J2
Molecular Formula:
C6H10NNaO3
Molecular Weight:
167.1383
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Product Description
Catalog Number:
AG01A5J2
Chemical Name:
sodium 4-(methylcarbamoyl)butanoate
CAS Number:
1443981-40-5
Molecular Formula:
C6H10NNaO3
Molecular Weight:
167.1383
MDL Number:
MFCD24842919
IUPAC Name:
sodium;5-(methylamino)-5-oxopentanoate
InChI:
InChI=1S/C6H11NO3.Na/c1-7-5(8)3-2-4-6(9)10;/h2-4H2,1H3,(H,7,8)(H,9,10);/q;+1/p-1
InChI Key:
PFHOBHLFRQZURX-UHFFFAOYSA-M
SMILES:
CNC(=O)CCCC(=O)[O-].[Na+]
Properties
Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.056g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
167.14g/mol
Monoisotopic Mass:
167.056g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
69.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties