U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C10H18O
Molecular Weight 154.2493
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,4-CINEOLE

SMILES

CC(C)[C@]12CC[C@](C)(CC1)O2

InChI

InChIKey=RFFOTVCVTJUTAD-AOOOYVTPSA-N
InChI=1S/C10H18O/c1-8(2)10-6-4-9(3,11-10)5-7-10/h8H,4-7H2,1-3H3/t9-,10+

HIDE SMILES / InChI

Molecular Formula C10H18O
Molecular Weight 154.2493
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:05:03 GMT 2023
Edited
by admin
on Fri Dec 15 19:05:03 GMT 2023
Record UNII
B55JTU839B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,4-CINEOLE
FHFI  
Common Name English
P-MENTHANE, 1,4-EPOXY-
Systematic Name English
1,4-EPOXY-P-MENTHANE [HSDB]
Common Name English
1-METHYL-4-(1-METHYLETHYL)-7-OXABICYCLO(2.2.1)HEPTANE
Systematic Name English
FEMA NO. 3658
Code English
7-OXABICYCLO(2.2.1)HEPTANE, 1-METHYL-4-(1-METHYLETHYL)-
Systematic Name English
1,4-CINEOLE [FHFI]
Common Name English
ISOCINEOLE
Common Name English
7-OXABICYCLO(2.2.1)HEPTANE, 1-ISOPROPYL-4-METHYL-
Systematic Name English
(±)-1,4-CINEOLE
Common Name English
1,4-EPOXY-P-MENTHANE
HSDB  
Systematic Name English
1,4-CINEOL
Common Name English
Classification Tree Code System Code
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 19:05:03 GMT 2023 , Edited by admin on Fri Dec 15 19:05:03 GMT 2023
JECFA EVALUATION 1,4-CINEOLE
Created by admin on Fri Dec 15 19:05:03 GMT 2023 , Edited by admin on Fri Dec 15 19:05:03 GMT 2023
Code System Code Type Description
CHEBI
80788
Created by admin on Fri Dec 15 19:05:03 GMT 2023 , Edited by admin on Fri Dec 15 19:05:03 GMT 2023
PRIMARY
ECHA (EC/EINECS)
207-428-9
Created by admin on Fri Dec 15 19:05:03 GMT 2023 , Edited by admin on Fri Dec 15 19:05:03 GMT 2023
PRIMARY
PUBCHEM
10106
Created by admin on Fri Dec 15 19:05:03 GMT 2023 , Edited by admin on Fri Dec 15 19:05:03 GMT 2023
PRIMARY
FDA UNII
B55JTU839B
Created by admin on Fri Dec 15 19:05:03 GMT 2023 , Edited by admin on Fri Dec 15 19:05:03 GMT 2023
PRIMARY
JECFA MONOGRAPH
1242
Created by admin on Fri Dec 15 19:05:03 GMT 2023 , Edited by admin on Fri Dec 15 19:05:03 GMT 2023
PRIMARY
CAS
470-67-7
Created by admin on Fri Dec 15 19:05:03 GMT 2023 , Edited by admin on Fri Dec 15 19:05:03 GMT 2023
PRIMARY
MESH
C058951
Created by admin on Fri Dec 15 19:05:03 GMT 2023 , Edited by admin on Fri Dec 15 19:05:03 GMT 2023
PRIMARY
EPA CompTox
DTXSID3047396
Created by admin on Fri Dec 15 19:05:03 GMT 2023 , Edited by admin on Fri Dec 15 19:05:03 GMT 2023
PRIMARY
HSDB
5425
Created by admin on Fri Dec 15 19:05:03 GMT 2023 , Edited by admin on Fri Dec 15 19:05:03 GMT 2023
PRIMARY