Benzoic acid, 4-[bis[2-[(methylsulfonyl)oxy]ethyl]amino]-, ethyl ester structure

Benzoic acid, 4-[bis[2-[(methylsulfonyl)oxy]ethyl]amino]-, ethyl ester

ethyl 4-[bis(2-methylsulfonyloxyethyl)amino]benzoate

Also Known As: Benzoic acid, ethyl ester|Benzoic acid, methyl ester|NCI60_004455|ethyl 4-[bis(2-methylsulfonyloxyethyl)amino]benzoate|Benzoic acid, 4-[bis[2-[(methylsulfonyl)oxy]ethyl]amino]-, ethyl ester|Ethyl 4-(bis{2-[(methanesulfonyl)oxy]ethyl}amino)benzoate|Benzoic acid, 4-[bis[2-[(methylsulfonyl)oxy]ethyl]amino]-, methyl ester|p-[N,N-Bis-(2-methansulfonyloxy-ethyl)-amino]-benzoesaeure-ethylester

CAS: 64977-07-7
Molecular Formula C15H23NO8S2
Molecular Weight 409.08652 g/mol
LogP 1.1
Topological Polar Surface Area 133.0 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 9
Rotatable Bonds 12
Exact Mass 409.08652
Monoisotopic Mass 409.08652
Heavy Atoms 26
Complexity 590.0

Chemical Identifiers

CAS Number 64977-07-7
SMILES CCOC(=O)C1=CC=C(C=C1)N(CCOS(=O)(=O)C)CCOS(=O)(=O)C
InChIKey GLYHKOMBOQZZTG-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.

Heterocyclic Building Blocks (11 patents) Organic Building Blocks (2 patents) Pharmaceutical Intermediates (8 patents)

Product Overview

Benzoic acid, 4-[bis[2-[(methylsulfonyl)oxy]ethyl]amino]-, ethyl ester (CAS 64977-07-7), with molecular formula C15H23NO8S2 and molecular weight 409.08652 g/mol. IUPAC: ethyl 4-[bis(2-methylsulfonyloxyethyl)amino]benzoate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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