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1,3,5-Trimethylpyrazole

1,3,5-Trimethylpyrazole structure

CAS No:
1072-91-9
Formula:
C6H10N2
Chemical Name:
1,3,5-Trimethylpyrazole
Synonyms:
AKOSPAO-1133;BUTTPARK15357-40;VITAS-BBTBB000655;1,3,5-TRIMETHYLPYRAZOLE;Pyrazole,1,3,5-trimethyl-;1,3,5-TRIMETHYL-1H-PYRAZOLE;1,3,5,-Trimethylpyrazole,99%;1,3,5-Trimethylpyrazole,98%;1,3,5,-TRIMETHYLPYRAZOLE99%;1H-Pyrazole,1,3,5-trimethyl-
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

White Low-Mekting Solid

1,3,5-Trimethylpyrazole Basic Attributes

Molecular Weight：

110.16

Exact Mass：

110.084396

UNII：

63938V7Z82

DSSTox ID：

DTXSID70147951

HScode：

29331990

Characteristics

PSA：

17.8

XLogP3：

Appearance：

Solid.

Density：

0.93

Melting Point：

38-41 °C(lit.)

Boiling Point：

168-170 °C

Flash Point：

93 °F

Refractive Index：

1.4589

Storage Conditions：

Store in a cool, dry place. Store in a tightly closed container.

Vapor Pressure：

3.17mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

Transport codes：

UN 1325 4.1/PG 3

wgk germany：

hazard class code：

4.1

safety instructions：

16-26-36

Marks：

Xi,F

Precautionary statement(s)：

P210-P261-P305 + P351 + P338

Hazard Statements：

H228-H315-H319-H335

GHS Classification：

|Warning|H228 (100%): Flammable solid [Danger Flammable solids]|P210, P240, P241, P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P405, and P501|Aggregated GHS information provided by 43 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:110.16
XLogP3:1
Hydrogen Bond Acceptor Count:1
Exact Mass:110.084398327
Monoisotopic Mass:110.084398327
Topological Polar Surface Area:17.8
Heavy Atom Count:8
Complexity:82.6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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1,3,5-Trimethylpyrazole

CAS No.: 1072-91-9

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CAS No.: 1072-91-9

Grade: Pharmaceutical Grade

Content: 99%

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