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Details

Stereochemistry RACEMIC
Molecular Formula C16H12O2S
Molecular Weight 268.33
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,2-DIHYDROBENZO(B)NAPHTHO(2,1-D)THIOPHENE-1,2-DIOL, TRANS-

SMILES

O[C@H]1C=CC2=CC=C3C4=C(SC3=C2[C@@H]1O)C=CC=C4

InChI

InChIKey=BYFVXOICIXESGI-SWLSCSKDSA-N
InChI=1S/C16H12O2S/c17-12-8-6-9-5-7-11-10-3-1-2-4-13(10)19-16(11)14(9)15(12)18/h1-8,12,15,17-18H/t12-,15+/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H12O2S
Molecular Weight 268.33
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:44:27 GMT 2025
Edited
by admin
on Mon Mar 31 22:44:27 GMT 2025
Record UNII
94R8X2QE8N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZO(B)NAPHTHO(2,1-D)THIOPHENE-1,2-DIOL, 1,2-DIHYDRO-, TRANS-
Preferred Name English
1,2-DIHYDROBENZO(B)NAPHTHO(2,1-D)THIOPHENE-1,2-DIOL, TRANS-
Systematic Name English
BENZO(B)NAPHTHO(2,1-D)THIOPHENE-1,2-DIOL, 1,2-DIHYDRO-, TRANS-(±)-
Systematic Name English
Code System Code Type Description
CAS
125847-45-2
Created by admin on Mon Mar 31 22:44:27 GMT 2025 , Edited by admin on Mon Mar 31 22:44:27 GMT 2025
PRIMARY
PUBCHEM
130815
Created by admin on Mon Mar 31 22:44:27 GMT 2025 , Edited by admin on Mon Mar 31 22:44:27 GMT 2025
PRIMARY
FDA UNII
94R8X2QE8N
Created by admin on Mon Mar 31 22:44:27 GMT 2025 , Edited by admin on Mon Mar 31 22:44:27 GMT 2025
PRIMARY
EPA CompTox
DTXSID80925303
Created by admin on Mon Mar 31 22:44:27 GMT 2025 , Edited by admin on Mon Mar 31 22:44:27 GMT 2025
PRIMARY