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264145-76-8 | Cyclopropanecarboxylic acid, 3-methyl-2-buten-1-yl ester
CAS No: 264145-76-8 Catalog No: AG002T3W MDL No:
Product Description
Catalog Number:
AG002T3W
Chemical Name:
Cyclopropanecarboxylic acid, 3-methyl-2-buten-1-yl ester
CAS Number:
264145-76-8
Molecular Formula:
C9H14O2
Molecular Weight:
154.2063
IUPAC Name:
3-methylbut-2-enyl cyclopropanecarboxylate
InChI:
InChI=1S/C9H14O2/c1-7(2)5-6-11-9(10)8-3-4-8/h5,8H,3-4,6H2,1-2H3
InChI Key:
QKSQPNPCCOABAK-UHFFFAOYSA-N
SMILES:
O=C(C1CC1)OCC=C(C)C
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.099g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.209g/mol
Monoisotopic Mass:
154.099g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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