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Structure

2-Methylphenylmethanesulfonyl chloride

CAS
92614-55-6
Catalog Number
ACM92614556
Category
Other Products
Molecular Weight
204.67
Molecular Formula
C8H9ClO2S

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Specification

Synonyms
2-Methylphenylmethanesulfonyl chloride;o-Tolylmethanesulfonyl chloride
IUPAC Name
(2-methylphenyl)methanesulfonyl chloride
Canonical SMILES
CC1=CC=CC=C1CS(=O)(=O)Cl
InChI Key
NDMREUGSHNSYBI-UHFFFAOYSA-N
Boiling Point
307.9ºC at 760mmHg
Melting Point
52ºC
Flash Point
140ºC
Density
1.325g/cm³
Exact Mass
204.00100
Hazard Statements
C: Corrosive;
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of 2-Methylphenylmethanesulfonyl chloride?

The molecular formula of 2-Methylphenylmethanesulfonyl chloride is C8H9ClO2S.

What is the molecular weight of 2-Methylphenylmethanesulfonyl chloride?

The molecular weight of 2-Methylphenylmethanesulfonyl chloride is 204.67 g/mol.

What is the IUPAC name of 2-Methylphenylmethanesulfonyl chloride?

The IUPAC name of 2-Methylphenylmethanesulfonyl chloride is (2-methylphenyl)methanesulfonyl chloride.

What is the InChIKey of 2-Methylphenylmethanesulfonyl chloride?

The InChIKey of 2-Methylphenylmethanesulfonyl chloride is NDMREUGSHNSYBI-UHFFFAOYSA-N.

How many hydrogen bond acceptor counts does 2-Methylphenylmethanesulfonyl chloride have?

2-Methylphenylmethanesulfonyl chloride has 2 hydrogen bond acceptor counts.

What is the topological polar surface area of 2-Methylphenylmethanesulfonyl chloride?

The topological polar surface area of 2-Methylphenylmethanesulfonyl chloride is 42.5 Ų.

Is 2-Methylphenylmethanesulfonyl chloride a canonicalized compound?

Yes, 2-Methylphenylmethanesulfonyl chloride is a canonicalized compound.

What is the XLogP3-AA value of 2-Methylphenylmethanesulfonyl chloride?

The XLogP3-AA value of 2-Methylphenylmethanesulfonyl chloride is 2.2.

How many rotatable bond counts does 2-Methylphenylmethanesulfonyl chloride have?

2-Methylphenylmethanesulfonyl chloride has 2 rotatable bond counts.

What is the exact mass of 2-Methylphenylmethanesulfonyl chloride?

The exact mass of 2-Methylphenylmethanesulfonyl chloride is 204.0011784 g/mol.

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