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

Details

Stereochemistry ACHIRAL
Molecular Formula C22H30O4
Molecular Weight 358.4712
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,2'-DIHYDROXY-3,3'-DI-TERT-BUTYL-5,5'-DIMETHOXYDIPHENYL

SMILES

COC1=CC(=C(O)C(=C1)C2=CC(OC)=CC(=C2O)C(C)(C)C)C(C)(C)C

InChI

InChIKey=CBYWHFTZNVZQHV-UHFFFAOYSA-N
InChI=1S/C22H30O4/c1-21(2,3)17-11-13(25-7)9-15(19(17)23)16-10-14(26-8)12-18(20(16)24)22(4,5)6/h9-12,23-24H,1-8H3

HIDE SMILES / InChI

Molecular Formula C22H30O4
Molecular Weight 358.4712
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
3,3'-Di-tert-butyl-5,5'-dimethoxy-biphenyl-2,2'-diol.
2009 Jun 24
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:45:42 GMT 2023
Edited
by admin
on Fri Dec 15 19:45:42 GMT 2023
Record UNII
S16M65880C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,2'-DIHYDROXY-3,3'-DI-TERT-BUTYL-5,5'-DIMETHOXYDIPHENYL
Common Name English
3,3'-DI-TERT-BUTYL-2,2'-DIHYDROXY-5,5'-DIMETHOXYBIPHENYL
Systematic Name English
6,6'-DI(TERT-BUTYL)-4,4'-DIMETHOXY-2,2'-BIPHENOL
Systematic Name English
O,O'-BIPHENOL, 6,6'-DI-TERT-BUTYL-4,4'-DIMETHOXY-
Systematic Name English
3,3'-DI-TERT-BUTYL-5,5'-DIMETHOXY-2,2'-BIPHENYLDIOL
Systematic Name English
3,3'-DI-TERT-BUTYL-2,2'-DIHYDROXY-5,5'-DIMETHOXYDIPHENYL
Common Name English
2,2'-DIHYDROXY-3,3'-DI-TERT-BUTYL-5,5'-DIMETHOXY-1,1'-BIPHENYL
Systematic Name English
2,2'-DIHYDROXY-5,5'-DIMETHOXY-3,3'-DI-TERT-BUTYLBIPHENYL
Systematic Name English
3,3'-DI-TERT-BUTYL-2,2'-DIHYDROXY-5,5'-DIMETHOXY-1,1'-BIPHENYL
Systematic Name English
3,3'-DI-TERT-BUTYL-5,5'-DIMETHOXYBIPHENYL-2,2'-DIOL
Systematic Name English
2,2'-BIPHENYLDIOL, 3,3'-DI-TERT-BUTYL-5,5'-DIMETHOXY-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID00930919
Created by admin on Fri Dec 15 19:45:43 GMT 2023 , Edited by admin on Fri Dec 15 19:45:43 GMT 2023
PRIMARY
CAS
14078-41-2
Created by admin on Fri Dec 15 19:45:43 GMT 2023 , Edited by admin on Fri Dec 15 19:45:43 GMT 2023
PRIMARY
PUBCHEM
119234
Created by admin on Fri Dec 15 19:45:43 GMT 2023 , Edited by admin on Fri Dec 15 19:45:43 GMT 2023
PRIMARY
FDA UNII
S16M65880C
Created by admin on Fri Dec 15 19:45:43 GMT 2023 , Edited by admin on Fri Dec 15 19:45:43 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE