1-CHLOROMETHYLPYRENE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H11Cl
Molecular Weight	250.722
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-CHLOROMETHYLPYRENE

Structure Search

SMILES

ClCC1=C2C=CC3=CC=CC4=CC=C(C=C1)C2=C34

InChI

InChIKey=MVNXSXOJYGSNQZ-UHFFFAOYSA-N

InChI=1S/C17H11Cl/c18-10-14-7-6-13-5-4-11-2-1-3-12-8-9-15(14)17(13)16(11)12/h1-9H,10H2

HIDE SMILES / InChI

Molecular Formula	C17H11Cl
Molecular Weight	250.722
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:48:52 GMT 2025` Edited by `admin` on `Mon Mar 31 21:48:52 GMT 2025`
Record UNII	B7AEW53FE3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-CHLOROMETHYLPYRENE

Systematic Name

English

NSC-133487

Preferred Name

English

PYRENE, 1-(CHLOROMETHYL)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID00148597

Created by admin on Mon Mar 31 21:48:52 GMT 2025 , Edited by admin on Mon Mar 31 21:48:52 GMT 2025

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FDA UNII

B7AEW53FE3

Created by admin on Mon Mar 31 21:48:52 GMT 2025 , Edited by admin on Mon Mar 31 21:48:52 GMT 2025

PRIMARY

PUBCHEM

97581

Created by admin on Mon Mar 31 21:48:52 GMT 2025 , Edited by admin on Mon Mar 31 21:48:52 GMT 2025

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CAS

1086-00-6

Created by admin on Mon Mar 31 21:48:52 GMT 2025 , Edited by admin on Mon Mar 31 21:48:52 GMT 2025

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NSC

133487

Created by admin on Mon Mar 31 21:48:52 GMT 2025 , Edited by admin on Mon Mar 31 21:48:52 GMT 2025

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