CAS
913835-52-6 Purity
98%
913835-52-6 Purity
98%
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Boronic acid,b-[4-[[ethyl[(4-methoxyphenyl)methyl]amino]sulfonyl]phenyl]-
CAS
913835-55-9
Catalog Number
ACM913835559
Category
Other Products
Molecular Weight
349.2097
Molecular Formula
C16H20BNO5S
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Specification
Synonyms
913835-55-9, 4-(N-Ethyl-N-(4-methoxybenzyl)sulfamoyl)phenylboronic acid, (4-(N-Ethyl-N-(4-methoxybenzyl)sulfamoyl)phenyl)boronic acid, 4-[N-Ethyl-N-(4-methoxybenzyl)sulphamoyl]benzeneboronic acid, ACMC-209r9k, CTK3I6370, MolPort-001-768-315, ANW-39606, OR3444, AKOS015838660, AG-H-74926, AK-93138, BD230847, KB-35103, B-4462, I01-11346, 4-(N-Ethyl-N-(4-methoxybenzyl)sulfamoyl)phenylboronic acid,, 4-{ethyl[(4-methoxyphenyl)methyl]sulfamoyl}phenylboronic acid, Boronic acid, B-[4-[[ethyl[(4-methoxyphenyl)methyl]amino]sulfonyl]phenyl]-
IUPAC Name
[4-[ethyl-[(4-methoxyphenyl)methyl]sulfamoyl]phenyl]boronic acid
SMILES
B(C1=CC=C(C=C1)S(=O)(=O)N(CC)CC2=CC=C(C=C2)OC)(O)O
InChI Key
YDJYSSQVBYJDIJ-UHFFFAOYSA-N
Boiling Point
552.7ºC at 760 mmHg
Melting Point
98-102ºC
Flash Point
288ºC
Density
1.32g/cm³
Exact Mass
349.11600
Hazard Statements
Xi
H-Bond Acceptor
6
H-Bond Donor
2
What is the molecular formula of Boronic acid,b-[4-[[ethyl[(4-methoxyphenyl)methyl]amino]sulfonyl]phenyl]?
The molecular formula is C16H20BNO5S.
When was this compound created and last modified?
It was created on 2009-07-21 and last modified on 2023-12-30.
What is the IUPAC Name of this compound?
The IUPAC Name is [4-[ethyl-[(4-methoxyphenyl)methyl]sulfamoyl]phenyl]boronic acid.
What is the molecular weight of this compound?
The molecular weight is 349.2 g/mol.
What is the InChIKey of this compound?
The InChIKey is YDJYSSQVBYJDIJ-UHFFFAOYSA-N.
How many hydrogen bond donor counts are there in this compound?
There are 2 hydrogen bond donor counts.
How many hydrogen bond acceptor counts are there in this compound?
There are 6 hydrogen bond acceptor counts.
What is the Exact Mass of this compound?
The Exact Mass is 349.1155241 g/mol.
How many rotatable bond counts are there in this compound?
There are 7 rotatable bond counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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