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3,6-Diaminocarbazole

3,6-Diaminocarbazole structure

CAS No:
86-71-5
Formula:
C12H11N3
Chemical Name:
3,6-Diaminocarbazole
Synonyms:
9H-Carbazole-3,6-diamine;Carbazole,3,6-diamino-;3,6-Diaminocarbazole;NSC 49770;3,6-Diamino-9H-carbazole
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

White to yellow to grey solid

3,6-Diaminocarbazole Basic Attributes

Molecular Weight：

197.236

Exact Mass：

197.24

EC Number：

201-692-9

UNII：

UR9L7T736V

NSC Number：

49770

DSSTox ID：

DTXSID60235336

HScode：

2933990090

Characteristics

PSA：

67.83000

XLogP3：

1.16

Density：

1.4±0.1 g/cm3

Melting Point：

276-279 °C

Boiling Point：

526.9±30.0 °C at 760 mmHg

Flash Point：

305.7±11.8 °C

Refractive Index：

1.889

Safety Information

Transport codes：

UN 3259 8/PG 3

Precautionary statement(s)：

P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (97.44%): 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 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:197.24
XLogP3:2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:2
Exact Mass:197.095297364
Monoisotopic Mass:197.095297364
Topological Polar Surface Area:67.8
Heavy Atom Count:15
Complexity:219
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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