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Details

Stereochemistry ACHIRAL
Molecular Formula C5H12OS
Molecular Weight 120.213
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(Isopropylthio)ethanol

SMILES

CC(C)SCCO

InChI

InChIKey=QGONIKZRWOOHBB-UHFFFAOYSA-N
InChI=1S/C5H12OS/c1-5(2)7-4-3-6/h5-6H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C5H12OS
Molecular Weight 120.213
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 11:59:05 GMT 2023
Edited
by admin
on Sat Dec 16 11:59:05 GMT 2023
Record UNII
2G6P9RR4EM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(Isopropylthio)ethanol
Systematic Name English
2-(Propan-2-ylsulfanyl)ethan-1-ol
Systematic Name English
Ethanol, 2-[(1-methylethyl)thio]-
Systematic Name English
Isopropylthioethanol
Systematic Name English
2-((1-METHYLETHYL)THIO)ETHANOL
Systematic Name English
2-Propan-2-ylsulfanylethanol
Systematic Name English
2-[(1-Methyl)ethylthio]ethanol
Systematic Name English
NSC-403991
Code English
Code System Code Type Description
NSC
403991
Created by admin on Sat Dec 16 11:59:05 GMT 2023 , Edited by admin on Sat Dec 16 11:59:05 GMT 2023
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CAS
40811-49-2
Created by admin on Sat Dec 16 11:59:05 GMT 2023 , Edited by admin on Sat Dec 16 11:59:05 GMT 2023
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FDA UNII
2G6P9RR4EM
Created by admin on Sat Dec 16 11:59:05 GMT 2023 , Edited by admin on Sat Dec 16 11:59:05 GMT 2023
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EPA CompTox
DTXSID90193798
Created by admin on Sat Dec 16 11:59:05 GMT 2023 , Edited by admin on Sat Dec 16 11:59:05 GMT 2023
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ECHA (EC/EINECS)
255-090-6
Created by admin on Sat Dec 16 11:59:05 GMT 2023 , Edited by admin on Sat Dec 16 11:59:05 GMT 2023
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PUBCHEM
101268
Created by admin on Sat Dec 16 11:59:05 GMT 2023 , Edited by admin on Sat Dec 16 11:59:05 GMT 2023
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