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1-(4-Isothiocyanatophenyl)-2-phenyldiazene

1-(4-Isothiocyanatophenyl)-2-phenyldiazene structure

CAS No:
7612-96-6
Formula:
C13H9N3S
Chemical Name:
1-(4-Isothiocyanatophenyl)-2-phenyldiazene
Synonyms:
Diazene,1-(4-isothiocyanatophenyl)-2-phenyl-;Isothiocyanic acid,p-(phenylazo)phenyl ester;Diazene,(4-isothiocyanatophenyl)phenyl-;1-(4-Isothiocyanatophenyl)-2-phenyldiazene;Isothiocyanic acid,ester with C.I. Solvent Yellow 7;Azobenzene-4-isothiocyanate;4-Isothiocyanatoazobenzene;4-Phenylazophenyl isothiocyanate;p-Phenylazophenyl isothiocyanate

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1-(4-Isothiocyanatophenyl)-2-phenyldiazene Basic Attributes

Molecular Weight：

239.29600

Exact Mass：

239.30

HScode：

2930909090

Characteristics

PSA：

69.17000

XLogP3：

4.83630

Density：

1.15g/cm3

Melting Point：

95 °C @ Solvent: Ethanol

Boiling Point：

402.4ºC at 760mmHg

Flash Point：

211.3ºC

Refractive Index：

1.629

Safety Information

Packing level：

Hazard category：

6.1

Transport codes：

UN 2811

hazard class code：

R20/21/22;R36/37/38

safety instructions：

S26-S36/37/39

Precautionary statement(s)：

P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501

Hazard Statements：

H302

Drug Information

MeSH Entry Terms：

4-phenylazophenylisothiocyanate

Computed Properties

Molecular Weight:239.30
XLogP3:5.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:239.05171847
Monoisotopic Mass:239.05171847
Topological Polar Surface Area:69.2
Heavy Atom Count:17
Complexity:296
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(4-Isothiocyanatophenyl)-2-phenyldiazene

Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties

1-(4-Isothiocyanatophenyl)-2-phenyldiazene

SDS

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