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3,5-Diaminobenzonitrile

3,5-Diaminobenzonitrile structure

CAS No:
33786-93-5
Formula:
C7H7N3
Chemical Name:
3,5-Diaminobenzonitrile
Synonyms:
Benzonitrile,3,5-diamino-;3,5-Diaminobenzonitrile
Categories:
Chemical Reagents > Organic Reagents

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3,5-Diaminobenzonitrile Basic Attributes

Molecular Weight：

133.154

Exact Mass：

133.15

DSSTox ID：

DTXSID30512525

HScode：

2926909090

Characteristics

PSA：

75.8

XLogP3：

1.88508

Density：

1.245g/cm3

Melting Point：

188-191 °C

Boiling Point：

405.506ºC at 760 mmHg

Flash Point：

199.043ºC

Refractive Index：

1.64

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

Marks：

Precautionary statement(s)：

P305 + P351 + P338

Hazard Statements：

H302-H319

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, 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:133.15
XLogP3:0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Exact Mass:133.063997236
Monoisotopic Mass:133.063997236
Topological Polar Surface Area:75.8
Heavy Atom Count:10
Complexity:148
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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33786-93-5 3,5-diaminobenzonitrile

CAS No.: 33786-93-5

Grade: Industrial Grade

Content: 95%

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