535-77-3 Purity
>95%
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Specification
The molecular formula of 7-Methylbenzo[a]pyrene is C21H14.
The molecular weight of 7-Methylbenzo[a]pyrene is 266.3 g/mol.
The IUPAC name of 7-Methylbenzo[a]pyrene is computed by Lexichem TK 2.7.0.
The InChI of 7-Methylbenzo[a]pyrene is InChI=1S/C21H14/c1-13-4-2-7-17-18-11-10-15-6-3-5-14-8-9-16(12-19(13)17)21(18)20(14)15/h2-12H,1H3.
The InChIKey of 7-Methylbenzo[a]pyrene is PYVWGNPFWVQISD-UHFFFAOYSA-N.
The canonical SMILES of 7-Methylbenzo[a]pyrene is CC1=C2C=C3C=CC4=C5C3=C(C2=CC=C1)C=CC5=CC=C4.
The CAS number of 7-Methylbenzo[a]pyrene is 63041-77-0.
The European Community (EC) number of 7-Methylbenzo[a]pyrene is 633-111-3.
The UNII of 7-Methylbenzo[a]pyrene is 6J4BS15OLB.