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21024-57-7 | 2-Butenoic acid, 3-cyclopropyl-, methyl ester, (2Z)-
CAS No: 21024-57-7 Catalog No: AG002KN6 MDL No:
Product Description
Catalog Number:
AG002KN6
Chemical Name:
2-Butenoic acid, 3-cyclopropyl-, methyl ester, (2Z)-
CAS Number:
21024-57-7
Molecular Formula:
C8H12O2
Molecular Weight:
140.1797
IUPAC Name:
methyl 3-cyclopropylbut-2-enoate
InChI:
InChI=1S/C8H12O2/c1-6(7-3-4-7)5-8(9)10-2/h5,7H,3-4H2,1-2H3
InChI Key:
HYAJWENQEZKGNL-UHFFFAOYSA-N
SMILES:
COC(=O)/C=C(\C1CC1)/C
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.084g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
140.182g/mol
Monoisotopic Mass:
140.084g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.1
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