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1,5-Diaminoanthraquinone

1,5-Diaminoanthraquinone structure

CAS No:
129-44-2
Formula:
C14H10N2O2
Chemical Name:
1,5-Diaminoanthraquinone
Synonyms:
9,10-Anthracenedione,1,5-diamino-;Anthraquinone,1,5-diamino-;1,5-Diamino-9,10-anthracenedione;1,5-Anthraquinonyldiamine;1,5-Diaminoanthraquinone;1,5-Diamino-9,10-anthraquinone;NSC 507213;Smoke Red F;NSC 63791;NSC 7213;1,5-Diamino-9,10-dihydroanthracene-9,10-dione;168681-31-0
Categories:
Specialty Chemicals

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1,5-Diaminoanthraquinone Basic Attributes

Molecular Weight：

238.246

Exact Mass：

238.24

EC Number：

204-947-2

UNII：

3ZXX3HK358

NSC Number：

63791|7213

DSSTox ID：

DTXSID1059602

HScode：

29147000

Characteristics

PSA：

86.2

XLogP3：

3.32

Appearance：

yellow powder

Density：

1.1907 (rough estimate)

Melting Point：

319 °C

Boiling Point：

380.84°C (rough estimate)

Flash Point：

287.6±30.1 °C

Refractive Index：

1.6500 (estimate)

Water Solubility：

Insoluble in water.

Vapor Pressure：

3.17E-12mmHg at 25°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

R36/37/38

safety instructions：

26-37/39

RTECS Number：

CB6400000

Marks：

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

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 40 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

1,5-diaminoanthraquinone

1,5-Diaminoanthraquinone Use and Manufacturing

Manufacturing Info：

9,10-Anthracenedione, 1,5-diamino-: ACTIVE

Computed Properties

Molecular Weight:238.24
XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Exact Mass:238.074227566
Monoisotopic Mass:238.074227566
Topological Polar Surface Area:86.2
Heavy Atom Count:18
Complexity:346
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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1,5-Diaminoanthraquinone

CAS No.: 129-44-2

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