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2-Amino-1-propene-1,1,3-tricarbonitrile

2-Amino-1-propene-1,1,3-tricarbonitrile structure

CAS No:
868-54-2
Formula:
C6H4N4
Chemical Name:
2-Amino-1-propene-1,1,3-tricarbonitrile
Synonyms:
1-Propene-1,1,3-tricarbonitrile,2-amino-;2-Amino-1-propene-1,1,3-tricarbonitrile;U 9189;2-Amino-1,1,3-tricyanopropene;2-Amino-1,1,3-tricyano-1-propene;TCAP;TRIAP;1,1,3-Tricyano-2-aminopropene;1,1,3-Tricyano-2-amino-1-propene;Upjohn 9189;Malononitrile,dimer;(1-Amino-2-cyanoethylidene)malononitrile;NSC 77901;2-Amino-1,1,3-propenetricarbonitrile;100032-66-4;112752-99-5;135345-20-9
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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Description

light pink to beige or light brownish

2-Amino-1-propene-1,1,3-tricarbonitrile Basic Attributes

Molecular Weight：

132.12

Exact Mass：

132.12

EC Number：

212-777-5

UNII：

OC6G895YHN

NSC Number：

77901

DSSTox ID：

DTXSID80235813

HScode：

2926909090

Characteristics

PSA：

97.4

XLogP3：

-0.1

Appearance：

light pink to beige or light brownish

Density：

1.3±0.1 g/cm3

Melting Point：

170-173 °C

Boiling Point：

591.9°C at 760 mmHg

Flash Point：

311.8±30.1 °C

Refractive Index：

1.541

Storage Conditions：

2-8°C

Safety Information

Hazard category：

6.1

Transport codes：

UN 3259 8/PG 3

wgk germany：

hazard class code：

safety instructions：

22-24/25

RTECS Number：

UD2340000

Marks：

Precautionary statement(s)：

P264, P270, P301+P312, P330, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 41 companies from 3 notifications to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

1,1,3-tricyano-2-amino-1-propene

Computed Properties

Molecular Weight:132.12
XLogP3:-0.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:132.043596145
Monoisotopic Mass:132.043596145
Topological Polar Surface Area:97.4
Heavy Atom Count:10
Complexity:278
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Amino-1-propene-1,1,3-tricarbonitrile

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
Latest News
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2-Amino-1-propene-1,1,3-tricarbonitrile

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