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Details

Stereochemistry ACHIRAL
Molecular Formula C11H16O2
Molecular Weight 180.2435
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-TERT-BUTYL-5-METHYLPYROCATECHOL

SMILES

CC1=CC(=C(O)C(O)=C1)C(C)(C)C

InChI

InChIKey=YKYXORJDSTUCTN-UHFFFAOYSA-N
InChI=1S/C11H16O2/c1-7-5-8(11(2,3)4)10(13)9(12)6-7/h5-6,12-13H,1-4H3

HIDE SMILES / InChI

Molecular Formula C11H16O2
Molecular Weight 180.2435
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 11:39:11 GMT 2023
Edited
by admin
on Sat Dec 16 11:39:11 GMT 2023
Record UNII
ET3NB8DS2N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-TERT-BUTYL-5-METHYLPYROCATECHOL
Systematic Name English
NSC-178992
Code English
3-(1,1-DIMETHYLETHYL)-5-METHYL-1,2-BENZENEDIOL
Systematic Name English
1,2-BENZENEDIOL, 3-(1,1-DIMETHYLETHYL)-5-METHYL-
Systematic Name English
Code System Code Type Description
NSC
178992
Created by admin on Sat Dec 16 11:39:11 GMT 2023 , Edited by admin on Sat Dec 16 11:39:11 GMT 2023
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FDA UNII
ET3NB8DS2N
Created by admin on Sat Dec 16 11:39:11 GMT 2023 , Edited by admin on Sat Dec 16 11:39:11 GMT 2023
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ECHA (EC/EINECS)
213-778-3
Created by admin on Sat Dec 16 11:39:11 GMT 2023 , Edited by admin on Sat Dec 16 11:39:11 GMT 2023
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PUBCHEM
66095
Created by admin on Sat Dec 16 11:39:11 GMT 2023 , Edited by admin on Sat Dec 16 11:39:11 GMT 2023
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EPA CompTox
DTXSID00143628
Created by admin on Sat Dec 16 11:39:11 GMT 2023 , Edited by admin on Sat Dec 16 11:39:11 GMT 2023
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CAS
1010-99-7
Created by admin on Sat Dec 16 11:39:11 GMT 2023 , Edited by admin on Sat Dec 16 11:39:11 GMT 2023
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