CAS
95356-83-5 Purity
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95356-83-5 Purity
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3-(Aminomethyl)-N-isopropylbenzenesulfonamide
CAS
953715-40-7
Catalog Number
ACM953715407
Category
Other Products
Molecular Weight
228.314
Molecular Formula
C10H16N2O2S
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Specification
Synonyms
3-(AMINOMETHYL)-N-ISOPROPYLBENZENESULFONAMIDE
IUPAC Name
3-(aminomethyl)-N-propan-2-ylbenzenesulfonamide
Canonical SMILES
CC(C)NS(=O)(=O)C1=CC=CC(=C1)CN
InChI Key
RBLLZFKXJIFDCL-UHFFFAOYSA-N
Boiling Point
379.4ºC at 760 mmHg
Flash Point
183.3ºC
Density
1.18g/cm³
Exact Mass
228.09300
H-Bond Acceptor
4
H-Bond Donor
2
What is the molecular formula of 3-(Aminomethyl)-N-isopropylbenzenesulfonamide?
The molecular formula is C10H16N2O2S.
When was 3-(Aminomethyl)-N-isopropylbenzenesulfonamide created in PubChem?
It was created on November 13, 2007.
What is the molecular weight of 3-(Aminomethyl)-N-isopropylbenzenesulfonamide?
The molecular weight is 228.31 g/mol.
What is the IUPAC Name of 3-(Aminomethyl)-N-isopropylbenzenesulfonamide?
The IUPAC Name is 3-(aminomethyl)-N-propan-2-ylbenzenesulfonamide.
What is the InChIKey of 3-(Aminomethyl)-N-isopropylbenzenesulfonamide?
The InChIKey is RBLLZFKXJIFDCL-UHFFFAOYSA-N.
How many hydrogen bond donor counts are in 3-(Aminomethyl)-N-isopropylbenzenesulfonamide?
There are 2 hydrogen bond donor counts.
What is the topological polar surface area of 3-(Aminomethyl)-N-isopropylbenzenesulfonamide?
The topological polar surface area is 80.6 angstrom squared.
Is the compound is canonicalized?
Yes, the compound is canonicalized.
How many rotatable bond counts are in 3-(Aminomethyl)-N-isopropylbenzenesulfonamide?
There are 4 rotatable bond counts.
What is the XLogP3-AA value of 3-(Aminomethyl)-N-isopropylbenzenesulfonamide?
The XLogP3-AA value is 0.5.
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