CAS
94291-61-9 Purity
96%
94291-61-9 Purity
96%
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3,3-Bis-(methylthio)butan-2-one oxime
CAS
94291-65-3
Catalog Number
ACM94291653
Category
Other Products
Molecular Weight
179.303520 [g/mol]
Molecular Formula
C6H13NOS2
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Specification
Synonyms
EINECS 304-890-4, 3,3-Bis(methylthio)butan-2-one oxime, 94291-65-3
IUPAC Name
(NZ)-N-[3,3-bis(methylsulfanyl)butan-2-ylidene]hydroxylamine
Canonical SMILES
CC(=NO)C(C)(SC)SC
InChI Key
OCKMYMYYFVZHNS-ALCCZGGFSA-N
EC Number
304-890-4
H-Bond Acceptor
2
H-Bond Donor
1
What is the molecular formula of 3,3-Bis-(methylthio)butan-2-one oxime?
The molecular formula is C6H13NOS2.
What are the synonyms for 3,3-Bis-(methylthio)butan-2-one oxime?
The synonyms are EINECS 304-890-4 and 3,3-bis-(Methylthio)butan-2-one oxime.
What is the molecular weight of 3,3-Bis-(methylthio)butan-2-one oxime?
The molecular weight is 179.3 g/mol.
What is the IUPAC name of 3,3-Bis-(methylthio)butan-2-one oxime?
The IUPAC name is (NZ)-N-[3,3-bis(methylsulfanyl)butan-2-ylidene]hydroxylamine.
What is the InChI of 3,3-Bis-(methylthio)butan-2-one oxime?
The InChI is InChI=1S/C6H13NOS2/c1-5(7-8)6(2,9-3)10-4/h8H,1-4H3/b7-5-.
What is the InChIKey of 3,3-Bis-(methylthio)butan-2-one oxime?
The InChIKey is OCKMYMYYFVZHNS-ALCCZGGFSA-N.
What is the canonical SMILES of 3,3-Bis-(methylthio)butan-2-one oxime?
The canonical SMILES is CC(=NO)C(C)(SC)SC.
What is the isomeric SMILES of 3,3-Bis-(methylthio)butan-2-one oxime?
The isomeric SMILES is C/C(=N/O)/C(C)(SC)SC.
What is the CAS number of 3,3-Bis-(methylthio)butan-2-one oxime?
The CAS number is 94291-65-3.
What is the molecular weight and XLogP3-AA value of 3,3-Bis-(methylthio)butan-2-one oxime?
The molecular weight is 179.3 g/mol, and the XLogP3-AA value is 1.9.
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