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

Details

Stereochemistry ACHIRAL
Molecular Formula C22H38
Molecular Weight 302.5371
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HEXADECYLBENZENE

SMILES

CCCCCCCCCCCCCCCCC1=CC=CC=C1

InChI

InChIKey=DEQLTFPCJRGSHW-UHFFFAOYSA-N
InChI=1S/C22H38/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-22-20-17-15-18-21-22/h15,17-18,20-21H,2-14,16,19H2,1H3

HIDE SMILES / InChI

Molecular Formula C22H38
Molecular Weight 302.5371
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

Substance Class Chemical
Record UNII
39HL93NE0R
Record Status Validated (UNII)
Record Version