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4-methyl-N-[2-[(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]benzenesulfonamide

4-methyl-N-[2-[(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]benzenesulfonamide structure

CAS No:
29136-73-0
Formula:
C20H17N3O5S
Chemical Name:
4-methyl-N-[2-[(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]benzenesulfonamide

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4-methyl-N-[2-[(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]benzenesulfonamide Basic Attributes

Molecular Weight：

411.43100

Exact Mass：

411.08889182

NSC Number：

120178

DSSTox ID：

DTXSID60419114

Characteristics

PSA：

132.96000

XLogP3：

5.83720

Density：

1.44g/cm3

Boiling Point：

557.7ºC at 760 mmHg

Flash Point：

291.1ºC

Refractive Index：

1.685

Vapor Pressure：

1.8E-12mmHg at 25°C

Safety Information

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:411.4
XLogP3:3.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:411.08889182
Monoisotopic Mass:411.08889182
Topological Polar Surface Area:133
Heavy Atom Count:29
Complexity:679
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-methyl-N-[2-[(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]benzenesulfonamide

Basic Attributes
Characteristics
Safety Information
Computed Properties

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