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3-Acetoxypyridine

3-Acetoxypyridine structure

CAS No:
17747-43-2
Formula:
C7H7NO2
Chemical Name:
3-Acetoxypyridine
Synonyms:
3-Pyridinol,3-acetate;3-Pyridinol,acetate (ester);3-Pyridinol,acetate;3-Acetoxypyridine;NSC 273047;3-Pyridyl acetate
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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3-Acetoxypyridine Basic Attributes

Molecular Weight：

137.14

Exact Mass：

137.14

EC Number：

241-742-7

UNII：

9E55385Q47

NSC Number：

273047

DSSTox ID：

DTXSID20170315

HScode：

2933399090

Characteristics

PSA：

39.2

XLogP3：

1.00690

Density：

1.141 g/mL at 25 °C(lit.)

Boiling Point：

92 °C @ Press: 9 Torr

Flash Point：

213 °F

Refractive Index：

n20/D 1.503(lit.)

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-37/39

Marks：

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

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

Computed Properties

Molecular Weight:137.14
XLogP3:0.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:137.047678466
Monoisotopic Mass:137.047678466
Topological Polar Surface Area:39.2
Heavy Atom Count:10
Complexity:125
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes