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30762-35-7 | 2-Cyclopropene-1-carboxylic acid, 2-methyl-3-propyl-, ethyl ester
CAS No: 30762-35-7 Catalog No: AG00317W MDL No:
Product Description
Catalog Number:
AG00317W
Chemical Name:
2-Cyclopropene-1-carboxylic acid, 2-methyl-3-propyl-, ethyl ester
CAS Number:
30762-35-7
Molecular Formula:
C10H16O2
Molecular Weight:
168.2328
IUPAC Name:
ethyl 2-methyl-3-propylcycloprop-2-ene-1-carboxylate
InChI:
InChI=1S/C10H16O2/c1-4-6-8-7(3)9(8)10(11)12-5-2/h9H,4-6H2,1-3H3
InChI Key:
JUMNWGNEGMIBHU-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1C(=C1CCC)C
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.115g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.236g/mol
Monoisotopic Mass:
168.115g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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