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N-[2-[(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]-4-methylbenzenesulfonamide

N-[2-[(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]-4-methylbenzenesulfonamide structure

CAS No:
28856-99-7
Formula:
C20H17BrN2O3S
Chemical Name:
N-[2-[(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]-4-methylbenzenesulfonamide

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N-[2-[(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]-4-methylbenzenesulfonamide Basic Attributes

Molecular Weight：

445.33000

Exact Mass：

444.01433 g/mol

NSC Number：

120179

DSSTox ID：

DTXSID20419115

Characteristics

PSA：

87.14000

XLogP3：

6.16830

Density：

1.638g/cm3

Boiling Point：

548.7ºC

Flash Point：

285.6ºC

Refractive Index：

1.74

Vapor Pressure：

4.33E-12mmHg at 25°C

Computed Properties

Molecular Weight:445.3
XLogP3:4.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:444.01433
Monoisotopic Mass:444.01433
Topological Polar Surface Area:87.1
Heavy Atom Count:27
Complexity:599
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-[2-[(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]-4-methylbenzenesulfonamide

Basic Attributes
Characteristics
Computed Properties

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