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4-Methyl-N,N-bis[2-[[(4-methylphenyl)sulfonyl]amino]ethyl]benzenesulfonamide

4-Methyl-N,N-bis[2-[[(4-methylphenyl)sulfonyl]amino]ethyl]benzenesulfonamide structure

CAS No:
56187-04-3
Formula:
C25H31N3O6S3
Chemical Name:
4-Methyl-N,N-bis[2-[[(4-methylphenyl)sulfonyl]amino]ethyl]benzenesulfonamide
Synonyms:
Benzenesulfonamide,4-methyl-N,N-bis[2-[[(4-methylphenyl)sulfonyl]amino]ethyl]-;4-Methyl-N,N-bis[2-[[(4-methylphenyl)sulfonyl]amino]ethyl]benzenesulfonamide;N,N′,N′′-Tris(p-tolylsulfonyl)diethylenetriamine;N,N′,N′′-Tritosyldiethylenetriamine;N,N′,N′′-Tris(4-tolylsulfonyl)diethylenetriamine;Diethylenetriamine tritosylate;1,4,7-Tris(p-tolylsulfonyl)-1,4,7-triazaheptane;1,4,7-Tris(p-toluenesulfonyl)-1,4,7-triazaheptane;1,4,7-Tritosyl-1,4,7-triazaheptane;N,N′,N′′-Tris(p-tolylsulfonyl)-3-azapentane-1,5-diamine;NSC 245019;NSC 249331;NSC 694885;N,N′,N′′-Tris(p-toluenesulfonyl)diethylenetriamine;N,N′,N′′-Tri(toluene-4-sulfonyl)diethylenetriamine

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4-Methyl-N,N-bis[2-[[(4-methylphenyl)sulfonyl]amino]ethyl]benzenesulfonamide Basic Attributes

Molecular Weight：

565.73

Exact Mass：

565.73

EC Number：

413-300-5

NSC Number：

694885|249331|245019

DSSTox ID：

DTXSID20311721

Characteristics

PSA：

155 Å²

Density：

1.325±0.06 g/cm3

Melting Point：

174.6 °C

Boiling Point：

736.9±70.0 °C(Predicted)

PKA：

10.38±0.50

Safety Information

wgk germany：

hazard class code：

safety instructions：

GHS Classification：

H413: May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]|P273, and P501|H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]|Aggregated GHS information provided by 3 companies from 1 notifications to the ECHA C&L Inventory.|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:565.7
XLogP3:3.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:12
Exact Mass:565.13749924
Monoisotopic Mass:565.13749924
Topological Polar Surface Area:155
Heavy Atom Count:37
Complexity:949
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Methyl-N,N-bis[2-[[(4-methylphenyl)sulfonyl]amino]ethyl]benzenesulfonamide

Basic Attributes
Characteristics
Safety Information
Computed Properties

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