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100683-08-7 | Cyclopropanecarboxylic acid, 1-methoxy-
CAS No: 100683-08-7 Catalog No: AG0002LX MDL No:MFCD19228478
Product Description
Catalog Number:
AG0002LX
Chemical Name:
Cyclopropanecarboxylic acid, 1-methoxy-
CAS Number:
100683-08-7
Molecular Formula:
C5H8O3
Molecular Weight:
116.1152
MDL Number:
MFCD19228478
IUPAC Name:
1-methoxycyclopropane-1-carboxylic acid
InChI:
InChI=1S/C5H8O3/c1-8-5(2-3-5)4(6)7/h2-3H2,1H3,(H,6,7)
InChI Key:
HPOWDCXQUZLJRQ-UHFFFAOYSA-N
SMILES:
COC1(CC1)C(=O)O
Properties
Complexity:
115
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.047g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
116.116g/mol
Monoisotopic Mass:
116.047g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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