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

Details

Stereochemistry ABSOLUTE
Molecular Formula C10H20O
Molecular Weight 156.2652
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .BETA.-CITRONELLOL, (R)-

SMILES

C[C@@H](CCO)CCC=C(C)C

InChI

InChIKey=QMVPMAAFGQKVCJ-SNVBAGLBSA-N
InChI=1S/C10H20O/c1-9(2)5-4-6-10(3)7-8-11/h5,10-11H,4,6-8H2,1-3H3/t10-/m1/s1

HIDE SMILES / InChI

Molecular Formula C10H20O
Molecular Weight 156.2652
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:24:20 GMT 2023
Edited
by admin
on Fri Dec 15 15:24:20 GMT 2023
Record UNII
P01OUT964K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.BETA.-CITRONELLOL, (R)-
Systematic Name English
CITRONELLOL [FCC]
Common Name English
CITRONELLOL
FCC   FHFI   INCI  
INCI  
Official Name English
CITRONELLOL, D-
Common Name English
BETA-CITRONELLOL, (R)-
Systematic Name English
3,7-DIMETHYL-6-OCTEN-1-OL
Systematic Name English
CITRONELLOL [INCI]
Common Name English
FEMA NO. 2309
Code English
R-(+)-.BETA.-CITRONELLOL
Common Name English
.BETA.-CITRONELLOL
Systematic Name English
CITRONELLOL [FHFI]
Common Name English
(R)-3,7-DIMETHYL-6-OCTEN-1-OL
Systematic Name English
D-CITRONELLOL
Common Name English
BETA-CITRONELLOL
Systematic Name English
.BETA.-CITRONELLOL, R-(+)-
Common Name English
(+)-CITRONELLOL
Systematic Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 167004
Created by admin on Fri Dec 15 15:24:20 GMT 2023 , Edited by admin on Fri Dec 15 15:24:20 GMT 2023
EC SCIENTIFIC COMMITTEE ON CONSUMER SAFETY OPINION SCCS/1459/11
Created by admin on Fri Dec 15 15:24:20 GMT 2023 , Edited by admin on Fri Dec 15 15:24:20 GMT 2023
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 15:24:20 GMT 2023 , Edited by admin on Fri Dec 15 15:24:20 GMT 2023
Code System Code Type Description
PUBCHEM
101977
Created by admin on Fri Dec 15 15:24:20 GMT 2023 , Edited by admin on Fri Dec 15 15:24:20 GMT 2023
PRIMARY
EVMPD
SUB79585
Created by admin on Fri Dec 15 15:24:20 GMT 2023 , Edited by admin on Fri Dec 15 15:24:20 GMT 2023
PRIMARY
SMS_ID
100000138971
Created by admin on Fri Dec 15 15:24:20 GMT 2023 , Edited by admin on Fri Dec 15 15:24:20 GMT 2023
PRIMARY
EPA CompTox
DTXSID00880647
Created by admin on Fri Dec 15 15:24:20 GMT 2023 , Edited by admin on Fri Dec 15 15:24:20 GMT 2023
PRIMARY
WIKIPEDIA
CITRONELLOL
Created by admin on Fri Dec 15 15:24:20 GMT 2023 , Edited by admin on Fri Dec 15 15:24:20 GMT 2023
PRIMARY
CAS
1117-61-9
Created by admin on Fri Dec 15 15:24:20 GMT 2023 , Edited by admin on Fri Dec 15 15:24:20 GMT 2023
PRIMARY
MESH
C007078
Created by admin on Fri Dec 15 15:24:20 GMT 2023 , Edited by admin on Fri Dec 15 15:24:20 GMT 2023
PRIMARY
DAILYMED
P01OUT964K
Created by admin on Fri Dec 15 15:24:20 GMT 2023 , Edited by admin on Fri Dec 15 15:24:20 GMT 2023
PRIMARY
FDA UNII
P01OUT964K
Created by admin on Fri Dec 15 15:24:20 GMT 2023 , Edited by admin on Fri Dec 15 15:24:20 GMT 2023
PRIMARY
RXCUI
1310495
Created by admin on Fri Dec 15 15:24:20 GMT 2023 , Edited by admin on Fri Dec 15 15:24:20 GMT 2023
PRIMARY RxNorm
CHEBI
50462
Created by admin on Fri Dec 15 15:24:20 GMT 2023 , Edited by admin on Fri Dec 15 15:24:20 GMT 2023
PRIMARY
JECFA MONOGRAPH
1228
Created by admin on Fri Dec 15 15:24:20 GMT 2023 , Edited by admin on Fri Dec 15 15:24:20 GMT 2023
PRIMARY
ECHA (EC/EINECS)
214-250-5
Created by admin on Fri Dec 15 15:24:20 GMT 2023 , Edited by admin on Fri Dec 15 15:24:20 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY