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Nicotinoyl chloride

Nicotinoyl chloride structure

CAS No:
10400-19-8
Formula:
C6H4ClNO
Chemical Name:
Nicotinoyl chloride
Synonyms:
3-Pyridinecarbonyl chloride;Nicotinoyl chloride;Nicotinic acid chloride;3-Pyridylcarbonyl chloride;Nicotinyl chloride;3-Pyridoyl chloride;3-Pyridinecarboxylic acid chloride;3-Pyridinylcarbonyl chloride
Categories:
Organic Chemistry > Carboxylic Acids and Derivatives

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Nicotinoyl chloride Basic Attributes

Molecular Weight：

141.55506

Exact Mass：

141.56

EC Number：

233-863-9

DSSTox ID：

DTXSID40146214

HScode：

2933399090

Characteristics

PSA：

XLogP3：

1.13

Density：

1.3±0.1 g/cm3

Melting Point：

15-16 °C

Boiling Point：

110-113 °C @ Press: 25-26 Torr

Flash Point：

84℃

Refractive Index：

1.547

Safety Information

hazard class code：

safety instructions：

26-27-36/37/39-45

Marks：

Nicotinoyl chloride Use and Manufacturing

Methods of Manufacturing

Use niacin in pyridine with phosphorus oxychloride chlorination system.

Uses

Intermediate of inositol nicotinate.

Computed Properties

Molecular Weight:141.55
XLogP3:1.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:140.9981414
Monoisotopic Mass:140.9981414
Topological Polar Surface Area:30
Heavy Atom Count:9
Complexity:116
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes