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Product Overview

Product Code

TRC-B287550

CAS Number

58917-67-2

Product Format

Neat

Molecular Formula

C20 H14 O3

Molecular Weight

302.3234

Product Categories

TRC, Biochemicals and Reagents, Carcinogens, Environmental Toxicology Reference Materials , Cancer Research Chemicals and Analytical Standards, API Reference Standards & Research Materials

Product Type

API

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Product Information

Chemical Data

Analyte Name

Benzo[a]pyrene Diol Epoxide

CAS Number

58917-67-2

Molecular Formula

C20 H14 O3

Molecular Weight

302.3234

Accurate Mass

302.0943

SMILES

O[C@@H]1[C@@H]2O[C@@H]2c3c(cc4ccc5cccc6ccc3c4c56)[C@H]1O

InChI

InChI=1S/C20H14O3/c21-17-13-8-11-5-4-9-2-1-3-10-6-7-12(15(11)14(9)10)16(13)19-20(23-19)18(17)22/h1-8,17-22H/t17-,18+,19-,20+/m1/s1

IUPAC

(3R,5S,6S,7R)-4-oxahexacyclo[11.6.2.02,8.03,5.010,20.017,21]henicosa-1(20),2(8),9,11,13(21),14,16,18-octaene-6,7-diol

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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Benzo[a]pyrene Diol Epoxide (>90%)

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