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261762-80-5 | Benzene, 1-chloro-3-fluoro-2-methoxy-4-methyl-
CAS No: 261762-80-5 Catalog No: AG002S0X MDL No:MFCD01631377
Product Description
Catalog Number:
AG002S0X
Chemical Name:
Benzene, 1-chloro-3-fluoro-2-methoxy-4-methyl-
CAS Number:
261762-80-5
Molecular Formula:
C8H8ClFO
Molecular Weight:
174.5999
MDL Number:
MFCD01631377
IUPAC Name:
1-chloro-3-fluoro-2-methoxy-4-methylbenzene
InChI:
InChI=1S/C8H8ClFO/c1-5-3-4-6(9)8(11-2)7(5)10/h3-4H,1-2H3
InChI Key:
SVMWIPGMWUYBGU-UHFFFAOYSA-N
SMILES:
COc1c(Cl)ccc(c1F)C
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.025g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.599g/mol
Monoisotopic Mass:
174.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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