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Structure

Boronicacid,b-[4-[[[(4-methoxyphenyl)methyl]methylamino]sulfonyl]phenyl]-

CAS
913835-54-8
Catalog Number
ACM913835548
Category
Other Products
Molecular Weight
335.18312
Molecular Formula
C15H18BNO5S

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Specification

Synonyms
913835-54-8, 4-(N-Methyl-N-(4-methoxybenzyl)sulfamoyl)phenylboronic acid, 4-[N-Methyl-N-(4-methoxybenzyl)sulphamoyl]benzeneboronic acid, ACMC-209r9j, CTK3I6372, MolPort-001-768-313, ANW-39605, OR3442, AKOS015850816, AG-H-74925, AK-94273, BD231620, KB-35115, FT-0688832, B-4461, I01-11551, (4-(N-(4-Methoxybenzyl)-N-methylsulfamoyl)phenyl)boronic acid, 4-(N-Methyl-N-(4-methoxybenzyl)sulfamoyl)phenylboronic acid,, 4-{[(4-methoxyphenyl)methyl](methyl)sulfamoyl}phenylboronic acid, Boronicacid, B-[4-[[[(4-methoxyphenyl)methyl]methylamino]sulfonyl]phenyl]-
IUPAC Name
[4-[(4-methoxyphenyl)methyl-methylsulfamoyl]phenyl]boronic acid
Canonical SMILES
B(C1=CC=C(C=C1)S(=O)(=O)N(C)CC2=CC=C(C=C2)OC)(O)O
InChI Key
ZBCCMISCUYAJDA-UHFFFAOYSA-N
Boiling Point
545.2ºC at 760 mmHg
Melting Point
137-139ºC
Flash Point
283.5ºC
Density
1.35g/cm³
Exact Mass
335.10000
Hazard Statements
Xi
H-Bond Acceptor
6
H-Bond Donor
2
What is the molecular formula of Boronic acid, b-[4-[[[(4-methoxyphenyl)methyl]methylamino]sulfonyl]phenyl]?

The molecular formula is C15H18BNO5S.

When was Boronic acid, b-[4-[[[(4-methoxyphenyl)methyl]methylamino]sulfonyl]phenyl] created?

It was created on July 21, 2009.

What is the IUPAC name of Boronic acid, b-[4-[[[(4-methoxyphenyl)methyl]methylamino]sulfonyl]phenyl]?

The IUPAC name is [4-[(4-methoxyphenyl)methyl-methylsulfamoyl]phenyl]boronic acid.

What is the InChIKey of Boronic acid, b-[4-[[[(4-methoxyphenyl)methyl]methylamino]sulfonyl]phenyl]?

The InChIKey is ZBCCMISCUYAJDA-UHFFFAOYSA-N.

How many hydrogen bond acceptor counts does Boronic acid, b-[4-[[[(4-methoxyphenyl)methyl]methylamino]sulfonyl]phenyl] have?

It has 6 hydrogen bond acceptor counts.

What is the topological polar surface area of Boronic acid, b-[4-[[[(4-methoxyphenyl)methyl]methylamino]sulfonyl]phenyl]?

The topological polar surface area is 95.4 Ų.

What is the exact mass of Boronic acid, b-[4-[[[(4-methoxyphenyl)methyl]methylamino]sulfonyl]phenyl]?

The exact mass is 335.0998740 g/mol.

How many rotatable bond counts does Boronic acid, b-[4-[[[(4-methoxyphenyl)methyl]methylamino]sulfonyl]phenyl] have?

It has 6 rotatable bond counts.

Is Boronic acid, b-[4-[[[(4-methoxyphenyl)methyl]methylamino]sulfonyl]phenyl] a canonicalized compound?

Yes, it is a canonicalized compound.

What is the molecular weight of Boronic acid, b-[4-[[[(4-methoxyphenyl)methyl]methylamino]sulfonyl]phenyl]?

The molecular weight is 335.2 g/mol.

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