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140626-59-1 | Phenol, 2,6-bis(chloromethyl)-
CAS No: 140626-59-1 Catalog No: AG001CKV MDL No:
Product Description
Catalog Number:
AG001CKV
Chemical Name:
Phenol, 2,6-bis(chloromethyl)-
CAS Number:
140626-59-1
Molecular Formula:
C8H8Cl2O
Molecular Weight:
191.0545
IUPAC Name:
2,6-bis(chloromethyl)phenol
InChI:
InChI=1S/C8H8Cl2O/c9-4-6-2-1-3-7(5-10)8(6)11/h1-3,11H,4-5H2
InChI Key:
KSIDUKAUQAWSTB-UHFFFAOYSA-N
SMILES:
ClCc1cccc(c1O)CCl
Properties
Complexity:
107
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.995g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.051g/mol
Monoisotopic Mass:
189.995g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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