Chrysene, 6-chloro-

HCID 56969CAS 95791-46-1
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Basic information

Standard SMILES
Clc1cc2c3ccccc3ccc2c2ccccc12
InChIKey
LVKLJLYFIFXBKM-UHFFFAOYSA-N
Molecular formula
C18H11Cl
Average molar mass
262.7 g/mol
Monoisotopic mass
262.054928

Names & identifiers

Preferred name
Chrysene, 6-chloro-
IUPAC
6-chlorochrysene
English name
6-CHLOROCHRYSENE
Molecular formula
C18H11Cl
Molecular weight
262.73

Names & synonyms

6-ChlorochryseneCHRYSENE, 6-CHLORO-CCRIS 5544BRN 3295116DTXSID102419623-05-00-02382 (Beilstein Handbook Reference)RefChem:334126DTXCID4016445395791-46-1SCHEMBL10484239LVKLJLYFIFXBKM-UHFFFAOYSA-N6-Chlorochrysene, CCRIS 5544, CHRYSENE, 6-CHLORO-, BRN 3295116, 95791-46-1, AC1L1M1Y, LS-53566, 3-05-00-02382 (Beilstein Handbook Reference)

Database identifiers

CAS
95791-46-1
PubChem CID
56969
DTXSID
DTXSID10241962
Nikkaji
J626.885D

Properties

Computed structural properties

XLogP
6.3
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
0
Heavy atoms
19

Physicochemical properties

Boiling point
465.3 · 465.3±14.0 °C(Predicted)
Density
1.289 · 1.289±0.06 g/cm3(Predicted)
EWG's Food Scores
1 · 1

Chemistry & industry

Suppliers5 total

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
上海艾梯西生物科技有限公司18721763493
欧洛德（武汉）光电科技有限公司18972952820
HUBEI DING KOSIN TECHNOLOGY+86-8613524650931 · [email protected]

Related reactions

6 records
New reaction record

Linked notes

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