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Details

Stereochemistry ACHIRAL
Molecular Formula C5H11O.Na
Molecular Weight 110.13
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM 2-METHYLBUTAN-2-OLATE

SMILES

[Na+].CCC(C)(C)[O-]

InChI

InChIKey=CGRKYEALWSRNJS-UHFFFAOYSA-N
InChI=1S/C5H11O.Na/c1-4-5(2,3)6;/h4H2,1-3H3;/q-1;+1

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C5H11O
Molecular Weight 87.1402
Charge -1
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 08:39:44 UTC 2023
Edited
by admin
on Sat Dec 16 08:39:44 UTC 2023
Record UNII
51Z39PY5Z8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM 2-METHYLBUTAN-2-OLATE
Systematic Name English
2-BUTANOL, 2-METHYL-, SODIUM SALT (1:1)
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
238-639-4
Created by admin on Sat Dec 16 08:39:44 UTC 2023 , Edited by admin on Sat Dec 16 08:39:44 UTC 2023
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PUBCHEM
2733478
Created by admin on Sat Dec 16 08:39:44 UTC 2023 , Edited by admin on Sat Dec 16 08:39:44 UTC 2023
PRIMARY
CAS
14593-46-5
Created by admin on Sat Dec 16 08:39:44 UTC 2023 , Edited by admin on Sat Dec 16 08:39:44 UTC 2023
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FDA UNII
51Z39PY5Z8
Created by admin on Sat Dec 16 08:39:44 UTC 2023 , Edited by admin on Sat Dec 16 08:39:44 UTC 2023
PRIMARY
EPA CompTox
DTXSID4044583
Created by admin on Sat Dec 16 08:39:44 UTC 2023 , Edited by admin on Sat Dec 16 08:39:44 UTC 2023
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