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3-Thiophenecarboxylic acid, 5-formyl-, methyl ester

3-Thiophenecarboxylic acid, 5-formyl-, methyl ester structure

CAS No:
67808-66-6
Formula:
C7H6O3S
Chemical Name:
3-Thiophenecarboxylic acid, 5-formyl-, methyl ester
Synonyms:
3-Thiophenecarboxylic acid,5-formyl-,methyl ester;Methyl 5-formylthiophene-3-carboxylate;5-Formylthiophene-3-carboxylic acid methyl ester;3-Methoxycarbonyl-thiophene-5-carboxaldehyde
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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3-Thiophenecarboxylic acid, 5-formyl-, methyl ester Basic Attributes

Molecular Weight：

170.19

Exact Mass：

170.19

DSSTox ID：

DTXSID20356011

HScode：

2934999090

Characteristics

PSA：

71.6

XLogP3：

1.24

Density：

1.3±0.1 g/cm3

Melting Point：

114-116 °C @ Solvent: Acetone, Water

Boiling Point：

296.0±25.0 °C at 760 mmHg

Flash Point：

132.8±23.2 °C

Refractive Index：

1.587

Safety Information

hazard class code：

R36/37/38:Irritating to eyes, respiratory system and skin .

safety instructions：

S37/39-S26

Marks：

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

Computed Properties

Molecular Weight:170.19
XLogP3:1.3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:170.00376522
Monoisotopic Mass:170.00376522
Topological Polar Surface Area:71.6
Heavy Atom Count:11
Complexity:169
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Methyl 2-formyl-4-thiophenecarboxylate

CAS No.: 67808-66-6

Content: 99.00%

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Guide of 3-Thiophenecarboxylic acid, 5-formyl-, methyl ester

Basic Attributes
Characteristics
Safety Information
Computed Properties
Recommended Suppliers
Latest News
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3-Thiophenecarboxylic acid, 5-formyl-, methyl ester

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