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5-[(Methoxycarbonyl)oxy]nicotinicacid

5-[(Methoxycarbonyl)oxy]nicotinicacid structure

CAS No:
325970-20-5
Formula:
C8H7NO5
Chemical Name:
5-[(Methoxycarbonyl)oxy]nicotinicacid
Synonyms:
ChemDiv2_000204;MLS000551302;Oprea1_097571;SMR000145228;STOCK2S-10175;5-[(Methoxycarbonyl)oxy]nicotinic acid;5-carbomethoxyoxynicotinic acid;5-methoxycarbonyloxy-3-pyridinecarboxylic acid

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5-[(Methoxycarbonyl)oxy]nicotinicacid Basic Attributes

Molecular Weight：

197.14

Exact Mass：

197.03242232 g/mol

Characteristics

PSA：

85.7 Å²

Density：

1.416±0.06 g/cm3

Boiling Point：

395.3±42.0 °C(Predicted)

PKA：

3.13±0.10

Safety Information

Hazard category：

IRRITANT

Computed Properties

Molecular Weight:197.14
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:197.03242232
Monoisotopic Mass:197.03242232
Topological Polar Surface Area:85.7
Heavy Atom Count:14
Complexity:230
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-[(Methoxycarbonyl)oxy]nicotinicacid

Basic Attributes
Characteristics
Safety Information
Computed Properties

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