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

Details

Stereochemistry ABSOLUTE
Molecular Formula C8H12O
Molecular Weight 124.1803
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BICYCLO(2.2.1)HEPT-5-ENE-2-METHANOL, (1R,2S,4R)-

SMILES

OC[C@H]1C[C@H]2C[C@@H]1C=C2

InChI

InChIKey=LUMNWCHHXDUKFI-GJMOJQLCSA-N
InChI=1S/C8H12O/c9-5-8-4-6-1-2-7(8)3-6/h1-2,6-9H,3-5H2/t6-,7+,8-/m1/s1

HIDE SMILES / InChI

Molecular Formula C8H12O
Molecular Weight 124.1803
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:15:11 GMT 2023
Edited
by admin
on Sat Dec 16 10:15:11 GMT 2023
Record UNII
UR7PNM6ZMH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BICYCLO(2.2.1)HEPT-5-ENE-2-METHANOL, (1R,2S,4R)-
Systematic Name English
(1.BETA.,2.BETA.,4.BETA.)-BICYCLO(2.2.1)HEPT-5-ENE-2-METHANOL
Systematic Name English
BICYCLO(2.2.1)HEPT-5-ENE-2-METHANOL, (1R-EXO)-
Systematic Name English
J231.994B
Code English
(1R,2S,4R)-BICYCLO(2.2.1)HEPT-5-ENE-2-METHANOL
Common Name English
(1.BETA.,4.BETA.)-NORBORNA-5-ENE-2.BETA.-METHANOL
Common Name English
Code System Code Type Description
PUBCHEM
1868170
Created by admin on Sat Dec 16 10:15:11 GMT 2023 , Edited by admin on Sat Dec 16 10:15:11 GMT 2023
PRIMARY
CAS
67671-05-0
Created by admin on Sat Dec 16 10:15:11 GMT 2023 , Edited by admin on Sat Dec 16 10:15:11 GMT 2023
PRIMARY
FDA UNII
UR7PNM6ZMH
Created by admin on Sat Dec 16 10:15:11 GMT 2023 , Edited by admin on Sat Dec 16 10:15:11 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> ENANTIOMER
DIASTEREOISOMER -> DIASTEREOISOMER
RACEMATE -> ENANTIOMER
DIASTEREOISOMER -> DIASTEREOISOMER