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Product Overview

Product Code

TRC-T293065

CAS Number

57405-00-2

Product Format

Neat

Molecular Formula

C34H24O4

Molecular Weight

496.55

Product Categories

Carcinogens, TRC, API Reference Standards & Research Materials

Product Type

API

Alternate CAS Number

169437-81-4

Documentation

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Product Information

Chemical Data

Analyte Name

trans-7,8,9,10-Tetrahydro-benzo[a]pyrene-7,8-diol Dibenzoate

CAS Number

57405-00-2

Molecular Formula

C34H24O4

Molecular Weight

496.55

Accurate Mass

496.17

SMILES

O=C(O[C@@H]1[C@@H](OC(C2=CC=CC=C2)=O)CCC3=C(C4=C56)C=CC6=CC=CC5=CC=C4C=C31)C7=CC=CC=C7

InChI

InChI=1S/C34H24O4/c35-33(23-8-3-1-4-9-23)37-29-19-18-26-27-17-16-22-13-7-12-21-14-15-25(31(27)30(21)22)20-28(26)32(29)38-34(36)24-10-5-2-6-11-24/h1-17,20,29,32H,18-19H2/t29-,32-/m0/s1

IUPAC

(7S,8S)-7,8,9,10-tetrahydrobenzo[pqr]tetraphene-7,8-diyl dibenzoate

Alternate CAS Number

169437-81-4

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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