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890097-70-8 | 3-(2-ACETOXYPHENYL)-2-CHLORO-1-PROPENE
CAS No: 890097-70-8 Catalog No: AG0043NV MDL No:
Product Description
Catalog Number:
AG0043NV
Chemical Name:
3-(2-ACETOXYPHENYL)-2-CHLORO-1-PROPENE
CAS Number:
890097-70-8
Molecular Formula:
C11H11ClO2
Molecular Weight:
210.6568
IUPAC Name:
[2-(2-chloroprop-2-enyl)phenyl] acetate
InChI:
InChI=1S/C11H11ClO2/c1-8(12)7-10-5-3-4-6-11(10)14-9(2)13/h3-6H,1,7H2,2H3
InChI Key:
ITMCVVDCKLOWOU-UHFFFAOYSA-N
SMILES:
ClC(=C)Cc1ccccc1OC(=O)C
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.045g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.657g/mol
Monoisotopic Mass:
210.045g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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