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Details

Stereochemistry RACEMIC
Molecular Formula C10H16
Molecular Weight 136.2344
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .BETA.-PHELLANDRENE

SMILES

CC(C)C1C=CC(=C)CC1

InChI

InChIKey=LFJQCDVYDGGFCH-UHFFFAOYSA-N
InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,6,8,10H,3,5,7H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C10H16
Molecular Weight 136.2344
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 09:02:57 UTC 2021
Edited
by admin
on Sat Jun 26 09:02:57 UTC 2021
Record UNII
2KK225M001
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.BETA.-PHELLANDRENE
MI  
Common Name English
2-P-MENTHADIENE
Common Name English
NSC-53044
Code English
CYCLOHEXENE, 3-METHYLENE-6-(1-METHYLETHYL)-
Systematic Name English
3-ISOPROPYL-6-METHYLENE-1-CYCLOHEXENE
Systematic Name English
PHELLANDRENE, BETA
Common Name English
P-MENTHA-1(7),2-DIENE
Systematic Name English
.BETA.-PHELLANDRENE [MI]
Common Name English
3-METHYLENE-6-(1-METHYLETHYL)CYCLOHEXENE
Systematic Name English
BETA-PHELLANDRENE [HSDB]
Common Name English
(+/-)-.BETA.-PHELLANDRENE
Common Name English
4-ISOPROPYL-1-METHYLENE-2-CYCLOHEXENE
Systematic Name English
Code System Code Type Description
EPA CompTox
555-10-2
Created by admin on Sat Jun 26 09:02:57 UTC 2021 , Edited by admin on Sat Jun 26 09:02:57 UTC 2021
PRIMARY
MERCK INDEX
M8586
Created by admin on Sat Jun 26 09:02:57 UTC 2021 , Edited by admin on Sat Jun 26 09:02:57 UTC 2021
PRIMARY Merck Index
HSDB
4080
Created by admin on Sat Jun 26 09:02:57 UTC 2021 , Edited by admin on Sat Jun 26 09:02:57 UTC 2021
PRIMARY
FDA UNII
2KK225M001
Created by admin on Sat Jun 26 09:02:57 UTC 2021 , Edited by admin on Sat Jun 26 09:02:57 UTC 2021
PRIMARY
CAS
555-10-2
Created by admin on Sat Jun 26 09:02:57 UTC 2021 , Edited by admin on Sat Jun 26 09:02:57 UTC 2021
PRIMARY
MESH
C058582
Created by admin on Sat Jun 26 09:02:57 UTC 2021 , Edited by admin on Sat Jun 26 09:02:57 UTC 2021
PRIMARY
PUBCHEM
11142
Created by admin on Sat Jun 26 09:02:57 UTC 2021 , Edited by admin on Sat Jun 26 09:02:57 UTC 2021
PRIMARY
ECHA (EC/EINECS)
209-081-9
Created by admin on Sat Jun 26 09:02:57 UTC 2021 , Edited by admin on Sat Jun 26 09:02:57 UTC 2021
PRIMARY
Related Record Type Details
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Monoterpene Class