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Details

Stereochemistry ACHIRAL
Molecular Formula C13H14
Molecular Weight 170.2503
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-ISOPROPYLNAPHTHALENE

SMILES

CC(C)C1=CC=C2C=CC=CC2=C1

InChI

InChIKey=TVYVQNHYIHAJTD-UHFFFAOYSA-N
InChI=1S/C13H14/c1-10(2)12-8-7-11-5-3-4-6-13(11)9-12/h3-10H,1-2H3

HIDE SMILES / InChI

Molecular Formula C13H14
Molecular Weight 170.2503
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Molecular modelling of the mouse cytochrome P450 CYP2F2 based on the CYP102 crystal structure template and selective CYP2F2 substrate interactions.
2002
Bioconcentration, biotransformation, and elimination of polycyclic aromatic hydrocarbons in sheepshead minnows (Cyprinodon variegatus) exposed to contaminated seawater.
2004 Jun
Toxicity and metabolism of methylnaphthalenes: comparison with naphthalene and 1-nitronaphthalene.
2009 Jun 16
Toxicity and inhibition of feeding and tunneling response of naphthalene and 10 derivatives on the formosan subterranean termite (Isoptera: Rhinotermitidae).
2010 Dec
Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:04:48 GMT 2023
Edited
by admin
on Fri Dec 15 18:04:48 GMT 2023
Record UNII
4DTR9UN8SR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-ISOPROPYLNAPHTHALENE
HSDB  
Systematic Name English
NAPHTHALENE, 2-ISOPROPYL-
Systematic Name English
NAPHTHALENE, 2-(1-METHYLETHYL)-
Systematic Name English
2-ISOPROPYLNAPHTHALENE [HSDB]
Common Name English
.BETA.-ISOPROPYLNAPHTHALENE
Systematic Name English
NSC-166466
Code English
Code System Code Type Description
HSDB
5863
Created by admin on Fri Dec 15 18:04:48 GMT 2023 , Edited by admin on Fri Dec 15 18:04:48 GMT 2023
PRIMARY
CAS
2027-17-0
Created by admin on Fri Dec 15 18:04:48 GMT 2023 , Edited by admin on Fri Dec 15 18:04:48 GMT 2023
PRIMARY
NSC
166466
Created by admin on Fri Dec 15 18:04:48 GMT 2023 , Edited by admin on Fri Dec 15 18:04:48 GMT 2023
PRIMARY
PUBCHEM
16238
Created by admin on Fri Dec 15 18:04:48 GMT 2023 , Edited by admin on Fri Dec 15 18:04:48 GMT 2023
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EPA CompTox
DTXSID7051844
Created by admin on Fri Dec 15 18:04:48 GMT 2023 , Edited by admin on Fri Dec 15 18:04:48 GMT 2023
PRIMARY
MESH
C028714
Created by admin on Fri Dec 15 18:04:48 GMT 2023 , Edited by admin on Fri Dec 15 18:04:48 GMT 2023
PRIMARY
FDA UNII
4DTR9UN8SR
Created by admin on Fri Dec 15 18:04:48 GMT 2023 , Edited by admin on Fri Dec 15 18:04:48 GMT 2023
PRIMARY
ECHA (EC/EINECS)
217-976-0
Created by admin on Fri Dec 15 18:04:48 GMT 2023 , Edited by admin on Fri Dec 15 18:04:48 GMT 2023
PRIMARY