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2-(3-CHLOROPHENYL)MALONDIALDEHYDE

2-(3-CHLOROPHENYL)MALONDIALDEHYDE structure

CAS No:
6299-85-0
Formula:
C6H4Cl2N2O2
Chemical Name:
2-(3-CHLOROPHENYL)MALONDIALDEHYDE
Synonyms:
NSC45044;2-(3-CHLOROPHENYL)MALONDIALDEHYDE;2,4-Dichloro-6-(methoxycarbonyl)pyrimidine;Methyl 2,4-dichloropyrimidine-6-carboxylate;Methyl 2,6-dichloropyrimidine-4-carboxylate;Methyl2,4-dichloropyrimidine-6-carboxylate99%;Methyl 2,4-dichloropyrimidine-6-carboxylate 99%;2,6-DICHLORO-PYRIMIDINE-4-CARBOXYLIC ACID ETHYL ESTER;2,6-Dichloro-pyrimidine-4-carboxylic acid methyl ester;4-PyriMidinecarboxylicacid, 2,6-dichloro-, Methyl ester
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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2-(3-CHLOROPHENYL)MALONDIALDEHYDE Basic Attributes

Molecular Weight：

207.01

Exact Mass：

205.964981

NSC Number：

45044

DSSTox ID：

DTXSID70286359

HScode：

2933599090

Characteristics

PSA：

52.1

XLogP3：

2.3

Appearance：

solid

Density：

1.5±0.1 g/cm3

Melting Point：

54-56ºC

Boiling Point：

306.1°C at 760 mmHg

Flash Point：

138.9±22.3 °C

Refractive Index：

1.552

Safety Information

Marks：

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (33.33%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 3 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

2-(3-CHLOROPHENYL)MALONDIALDEHYDE Use and Manufacturing

To a stirred suspension of orotic acid (CAS Number 65-86-1 , available from Alfa Aesar) (20.00 g, 128.140 mmol) in POCI

Computed Properties

Molecular Weight:207.01
XLogP3:2.3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:205.9649828
Monoisotopic Mass:205.9649828
Topological Polar Surface Area:52.1
Heavy Atom Count:12
Complexity:179
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(3-CHLOROPHENYL)MALONDIALDEHYDE

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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2-(3-CHLOROPHENYL)MALONDIALDEHYDE

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