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88637-83-6 | Benz[a]anthracene-7-methanol, 2-fluoro-12-methyl-
CAS No: 88637-83-6 Catalog No: AG00492K MDL No:
Product Description
Catalog Number:
AG00492K
Chemical Name:
Benz[a]anthracene-7-methanol, 2-fluoro-12-methyl-
CAS Number:
88637-83-6
Molecular Formula:
C20H15FO
Molecular Weight:
290.3309
IUPAC Name:
(2-fluoro-12-methylbenzo[a]anthracen-7-yl)methanol
InChI:
InChI=1S/C20H15FO/c1-12-15-4-2-3-5-16(15)19(11-22)17-9-7-13-6-8-14(21)10-18(13)20(12)17/h2-10,22H,11H2,1H3
InChI Key:
GJSOKVWUNHOUDB-UHFFFAOYSA-N
SMILES:
OCc1c2ccccc2c(c2c1ccc1c2cc(cc1)F)C
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.111g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
290.337g/mol
Monoisotopic Mass:
290.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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