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102674-87-3 | Propanoic acid, 3-(carboxyamino)-2-fluoro-
CAS No: 102674-87-3 Catalog No: AG00082W MDL No:
Product Description
Catalog Number:
AG00082W
Chemical Name:
Propanoic acid, 3-(carboxyamino)-2-fluoro-
CAS Number:
102674-87-3
Molecular Formula:
C4H6FNO4
Molecular Weight:
151.0931
IUPAC Name:
3-(carboxyamino)-2-fluoropropanoic acid
InChI:
InChI=1S/C4H6FNO4/c5-2(3(7)8)1-6-4(9)10/h2,6H,1H2,(H,7,8)(H,9,10)
InChI Key:
LOESHNCLSDGVGT-UHFFFAOYSA-N
SMILES:
OC(=O)NCC(C(=O)O)F
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.028g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
151.093g/mol
Monoisotopic Mass:
151.028g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
86.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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