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13719-57-8 | Benzene, 2-chloro-4-(chloromethyl)-1-methoxy-
CAS No: 13719-57-8 Catalog No: AG0012XC MDL No:MFCD00068624
Product Description
Catalog Number:
AG0012XC
Chemical Name:
Benzene, 2-chloro-4-(chloromethyl)-1-methoxy-
CAS Number:
13719-57-8
Molecular Formula:
C8H8Cl2O
Molecular Weight:
191.0545
MDL Number:
MFCD00068624
IUPAC Name:
2-chloro-4-(chloromethyl)-1-methoxybenzene
InChI:
InChI=1S/C8H8Cl2O/c1-11-8-3-2-6(5-9)4-7(8)10/h2-4H,5H2,1H3
InChI Key:
JAXSPAXDDROBLQ-UHFFFAOYSA-N
SMILES:
ClCc1ccc(c(c1)Cl)OC
Properties
Complexity:
119
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:
0
Isotope Atom Count:
0
Molecular Weight:
191.051g/mol
Monoisotopic Mass:
189.995g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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