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1260849-97-5 | 2-Furancarboxylic acid, 3-amino-
CAS No: 1260849-97-5 Catalog No: AG000RFC MDL No:MFCD13193687
Product Description
Catalog Number:
AG000RFC
Chemical Name:
2-Furancarboxylic acid, 3-amino-
CAS Number:
1260849-97-5
Molecular Formula:
C5H5NO3
Molecular Weight:
127.0981
MDL Number:
MFCD13193687
IUPAC Name:
3-aminofuran-2-carboxylic acid
InChI:
InChI=1S/C5H5NO3/c6-3-1-2-9-4(3)5(7)8/h1-2H,6H2,(H,7,8)
InChI Key:
KDFCUBIYBSEWBS-UHFFFAOYSA-N
SMILES:
OC(=O)c1occc1N
Properties
Complexity:
125
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.027g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
127.099g/mol
Monoisotopic Mass:
127.027g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
76.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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