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89237-96-7 | Oxirane, 2-(1-chlorocyclopropyl)-2-methyl-3-phenyl-
CAS No: 89237-96-7 Catalog No: AG0044FS MDL No:
Product Description
Catalog Number:
AG0044FS
Chemical Name:
Oxirane, 2-(1-chlorocyclopropyl)-2-methyl-3-phenyl-
CAS Number:
89237-96-7
Molecular Formula:
C12H13ClO
Molecular Weight:
208.6840
IUPAC Name:
2-(1-chlorocyclopropyl)-2-methyl-3-phenyloxirane
InChI:
InChI=1S/C12H13ClO/c1-11(12(13)7-8-12)10(14-11)9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3
InChI Key:
MBZHPOWCAQSHGQ-UHFFFAOYSA-N
SMILES:
CC1(OC1c1ccccc1)C1(Cl)CC1
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.065g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.685g/mol
Monoisotopic Mass:
208.065g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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