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1-Methyl-1,4,5,6-tetrahydro-cyclopentapyrazole-3-carboxylicacid

1-Methyl-1,4,5,6-tetrahydro-cyclopentapyrazole-3-carboxylicacid structure

CAS No:
854405-75-7
Formula:
C8H10N2O2
Chemical Name:
1-Methyl-1,4,5,6-tetrahydro-cyclopentapyrazole-3-carboxylicacid
Synonyms:
1-Methyl-1,4,5,6-tetrahydro-cyclopentapyrazole-3-carboxylic acid;1-Methyl-2H,4H,5H,6H-cyclopenta[c]pyrazole-3-carboxylic acid;1-methyl-1H,4H,5H,6H-cyclopenta[c]pyrazole-3-carboxylic acid;1-Methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid;3-Cyclopentapyrazolecarboxylic acid, 1,4,5,6-tetrahydro-1-methyl-

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1-Methyl-1,4,5,6-tetrahydro-cyclopentapyrazole-3-carboxylicacid Basic Attributes

Molecular Weight：

166.18

Exact Mass：

166.074227566

HScode：

2933990090

Characteristics

PSA：

55.12000

XLogP3：

0.60700

Density：

1.46±0.1 g/cm3

Boiling Point：

358.2±42.0 °C(Predicted)

PKA：

3.94±0.20

Safety Information

Hazard category：

IRRITANT

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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:166.18
XLogP3:0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:166.074227566
Monoisotopic Mass:166.074227566
Topological Polar Surface Area:55.1
Heavy Atom Count:12
Complexity:207
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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1-Methyl-1,4,5,6-tetrahydro-cyclopentapyrazole-3-carboxylic acid

CAS No.: 854405-75-7

Content: 99.00%

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Guide of 1-Methyl-1,4,5,6-tetrahydro-cyclopentapyrazole-3-carboxylicacid

Basic Attributes
Characteristics
Safety Information
Computed Properties
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