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88419-72-1 | 3-(2-Chloro-2-(4-chlorophenyl);vinyl);-2,2-dimethylcyclopropanecarboxylic acid
CAS No: 88419-72-1 Catalog No: AG004KL0 MDL No:MFCD22421621
Product Description
Catalog Number:
AG004KL0
Chemical Name:
3-(2-Chloro-2-(4-chlorophenyl);vinyl);-2,2-dimethylcyclopropanecarboxylic acid
CAS Number:
88419-72-1
Molecular Formula:
C14H14Cl2O2
Molecular Weight:
285.1658
MDL Number:
MFCD22421621
IUPAC Name:
3-[(Z)-2-chloro-2-(4-chlorophenyl)ethenyl]-2,2-dimethylcyclopropane-1-carboxylic acid
InChI:
InChI=1S/C14H14Cl2O2/c1-14(2)10(12(14)13(17)18)7-11(16)8-3-5-9(15)6-4-8/h3-7,10,12H,1-2H3,(H,17,18)/b11-7-
InChI Key:
OLKWYZYVQYPFIM-XFFZJAGNSA-N
SMILES:
Cl/C(=C\C1C(C1(C)C)C(=O)O)/c1ccc(cc1)Cl
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
284.037g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
285.164g/mol
Monoisotopic Mass:
284.037g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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