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1489-58-3 | 1,2-Cyclopropanedicarboxylic acid
CAS No: 1489-58-3 Catalog No: AG001LAF MDL No:MFCD00182375
Product Description
Catalog Number:
AG001LAF
Chemical Name:
1,2-Cyclopropanedicarboxylic acid
CAS Number:
1489-58-3
Molecular Formula:
C5H6O4
Molecular Weight:
130.0987
MDL Number:
MFCD00182375
IUPAC Name:
cyclopropane-1,2-dicarboxylic acid
InChI:
InChI=1S/C5H6O4/c6-4(7)2-1-3(2)5(8)9/h2-3H,1H2,(H,6,7)(H,8,9)
InChI Key:
RLWFMZKPPHHHCB-UHFFFAOYSA-N
SMILES:
OC(=O)C1CC1C(=O)O
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.027g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
130.099g/mol
Monoisotopic Mass:
130.027g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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