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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H12
Molecular Weight 108.1809
Optical Activity NONE
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRICYCLO(5.1.0.03,5)OCTANE, (1.ALPHA.,3.ALPHA.,5.ALPHA.,7.ALPHA.)-

SMILES

[H][C@@]12C[C@]1([H])C[C@]3([H])C[C@]3([H])C2

InChI

InChIKey=YZFVTGCKLQCIFB-SOSBWXJGSA-N
InChI=1S/C8H12/c1-5-3-7-2-8(7)4-6(1)5/h5-8H,1-4H2/t5-,6+,7+,8-

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
TRICYCLO(5.1.0.03,5)OCTANE, (1.ALPHA.,3.ALPHA.,5.ALPHA.,7.ALPHA.)-
Systematic Name English
REL-(1R,3S,5R,7S)-TRICYCLO(5.1.0.03,5)OCTANE
Systematic Name English
TRICYCLO(5.1.0.03,5)OCTANE, (1R,3S,5R,7S)-REL-
Systematic Name English
Code System Code Type Description
CAS
138284-15-8
Created by admin on Sat Dec 16 18:48:26 GMT 2023 , Edited by admin on Sat Dec 16 18:48:26 GMT 2023
PRIMARY
FDA UNII
Y5D3M693TG
Created by admin on Sat Dec 16 18:48:26 GMT 2023 , Edited by admin on Sat Dec 16 18:48:26 GMT 2023
PRIMARY
PUBCHEM
164512942
Created by admin on Sat Dec 16 18:48:26 GMT 2023 , Edited by admin on Sat Dec 16 18:48:26 GMT 2023
PRIMARY
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966