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Details

Stereochemistry ACHIRAL
Molecular Formula 2C10H13S.Zn
Molecular Weight 395.959
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ZINC 4-TERT-BUTYLTHIOPHENATE

SMILES

[Zn++].CC(C)(C)C1=CC=C([S-])C=C1.CC(C)(C)C2=CC=C([S-])C=C2

InChI

InChIKey=ZTZHAKLJVVVTKO-UHFFFAOYSA-L
InChI=1S/2C10H14S.Zn/c2*1-10(2,3)8-4-6-9(11)7-5-8;/h2*4-7,11H,1-3H3;/q;;+2/p-2

HIDE SMILES / InChI

Molecular Formula Zn
Molecular Weight 65.409
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C10H14S
Molecular Weight 166.283
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:01:40 GMT 2023
Edited
by admin
on Sat Dec 16 08:01:40 GMT 2023
Record UNII
4KQ51OEA0W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ZINC 4-TERT-BUTYLTHIOPHENATE
Systematic Name English
BENZENETHIOL, 4-(1,1-DIMETHYLETHYL)-, ZINC SALT
Common Name English
PITT-CONSOL 651
Brand Name English
BENZENETHIOL, 4-(1,1-DIMETHYLETHYL)-, ZINC SALT (2:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
18916239
Created by admin on Sat Dec 16 08:01:40 GMT 2023 , Edited by admin on Sat Dec 16 08:01:40 GMT 2023
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FDA UNII
4KQ51OEA0W
Created by admin on Sat Dec 16 08:01:40 GMT 2023 , Edited by admin on Sat Dec 16 08:01:40 GMT 2023
PRIMARY
CAS
4545-30-6
Created by admin on Sat Dec 16 08:01:40 GMT 2023 , Edited by admin on Sat Dec 16 08:01:40 GMT 2023
PRIMARY