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Details

Stereochemistry ACHIRAL
Molecular Formula C8H16
Molecular Weight 112.2126
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,4-DIMETHYLCYCLOHEXANE, TRANS-

SMILES

C[C@H]1CC[C@H](C)CC1

InChI

InChIKey=QRMPKOFEUHIBNM-ZKCHVHJHSA-N
InChI=1S/C8H16/c1-7-3-5-8(2)6-4-7/h7-8H,3-6H2,1-2H3/t7-,8-

HIDE SMILES / InChI

Molecular Formula C8H16
Molecular Weight 112.2126
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Metabolite fingerprinting in transgenic Nicotiana tabacum altered by the Escherichia coli glutamate dehydrogenase gene.
2005 Jun 30
Volatile biomarkers of pulmonary tuberculosis in the breath.
2007 Jan
Cp* iridium complexes give catalytic alkane hydroxylation with retention of stereochemistry.
2010 Sep 15
Substance Class Chemical
Created
by admin
on Fri Dec 15 20:32:58 GMT 2023
Edited
by admin
on Fri Dec 15 20:32:58 GMT 2023
Record UNII
8NUV3O4B1R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,4-DIMETHYLCYCLOHEXANE, TRANS-
Systematic Name English
TRANS-1,4-DIMETHYLCYCLOHEXANE
Systematic Name English
CYCLOHEXANE, 1,4-DIMETHYL-, TRANS-
Systematic Name English
CYCLOHEXANE, 1,4-DIMETHYL-, (E)
Systematic Name English
NSC-74162
Code English
Code System Code Type Description
CAS
2207-04-7
Created by admin on Fri Dec 15 20:32:58 GMT 2023 , Edited by admin on Fri Dec 15 20:32:58 GMT 2023
PRIMARY
EPA CompTox
DTXSID40101583
Created by admin on Fri Dec 15 20:32:58 GMT 2023 , Edited by admin on Fri Dec 15 20:32:58 GMT 2023
PRIMARY
ECHA (EC/EINECS)
218-622-8
Created by admin on Fri Dec 15 20:32:58 GMT 2023 , Edited by admin on Fri Dec 15 20:32:58 GMT 2023
PRIMARY
NSC
74162
Created by admin on Fri Dec 15 20:32:58 GMT 2023 , Edited by admin on Fri Dec 15 20:32:58 GMT 2023
PRIMARY
CHEBI
167603
Created by admin on Fri Dec 15 20:32:58 GMT 2023 , Edited by admin on Fri Dec 15 20:32:58 GMT 2023
PRIMARY
FDA UNII
8NUV3O4B1R
Created by admin on Fri Dec 15 20:32:58 GMT 2023 , Edited by admin on Fri Dec 15 20:32:58 GMT 2023
PRIMARY