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125218-55-5 | 3-Furancarboxylic acid, 3-aminotetrahydro-
CAS No: 125218-55-5 Catalog No: AG000NCJ MDL No:MFCD08460976
Product Description
Catalog Number:
AG000NCJ
Chemical Name:
3-Furancarboxylic acid, 3-aminotetrahydro-
CAS Number:
125218-55-5
Molecular Formula:
C5H9NO3
Molecular Weight:
131.1299
MDL Number:
MFCD08460976
IUPAC Name:
3-aminooxolane-3-carboxylic acid
InChI:
InChI=1S/C5H9NO3/c6-5(4(7)8)1-2-9-3-5/h1-3,6H2,(H,7,8)
InChI Key:
ATUWXXVBEAYCSQ-UHFFFAOYSA-N
SMILES:
OC(=O)C1(N)COCC1
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
131.058g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
131.131g/mol
Monoisotopic Mass:
131.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.6
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