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178486-30-1 | Benzene, 1-chloro-3-(chloromethyl)-5-methoxy-
CAS No: 178486-30-1 Catalog No: AG00262T MDL No:MFCD12547161
Product Description
Catalog Number:
AG00262T
Chemical Name:
Benzene, 1-chloro-3-(chloromethyl)-5-methoxy-
CAS Number:
178486-30-1
Molecular Formula:
C8H8Cl2O
Molecular Weight:
191.0545
MDL Number:
MFCD12547161
IUPAC Name:
1-chloro-3-(chloromethyl)-5-methoxybenzene
InChI:
InChI=1S/C8H8Cl2O/c1-11-8-3-6(5-9)2-7(10)4-8/h2-4H,5H2,1H3
InChI Key:
QSHIZISXBATBMJ-UHFFFAOYSA-N
SMILES:
ClCc1cc(OC)cc(c1)Cl
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:
2.9
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