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phthalonicacid

phthalonicacid structure

CAS No:
528-46-1
Formula:
C9H6O5
Chemical Name:
phthalonicacid
Synonyms:
Aids018114;Aids-018114;phthalonicacid;2-oxalobenzoicacid;2-(carboxycarbonyl)benzoicacid;α-Oxo-2-carboxybenzeneaceticacid;2-Carboxy-α-oxobenzeneaceticacid;2-(o-Carboxyphenyl)glyoxylicacid;2-Carboxy-alpha-oxobenzeneaceticacid

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phthalonicacid Basic Attributes

Molecular Weight：

194.14100

Exact Mass：

194.02200

DSSTox ID：

DTXSID10200776

HScode：

2918300090

Characteristics

PSA：

91.67000

XLogP3：

0.65210

Density：

1.515g/cm3

Melting Point：

140 °C

Boiling Point：

406.1ºC at 760mmHg

Flash Point：

213.6ºC

Refractive Index：

1.616

Water Solubility：

535g/L(15 ºC)

Drug Information

MeSH Entry Terms：

phthalonic acid

phthalonicacid Use and Manufacturing

Use Classification：

Environmental transformation -> Pesticide transformation products (metabolite, successor)

Agrochemical：

CBAA is a known environmental transformation product of Acequinocyl.

Computed Properties

Molecular Weight:194.14
XLogP3:0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:194.02152329
Monoisotopic Mass:194.02152329
Topological Polar Surface Area:91.7
Heavy Atom Count:14
Complexity:270
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: vanadium nitride; poly methyl acrylate; nitrohydrochloric acid; benzyl benzoate; dichloromethane sds; chloric acid formula

Guide of phthalonicacid

Basic Attributes
Characteristics
Drug Information
Use and Manufacturing
Computed Properties

phthalonicacid

SDS

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