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COMANICACID

COMANICACID structure

CAS No:
499-05-8
Formula:
C6H4O4
Chemical Name:
COMANICACID
Synonyms:
COMANICACID;COMMANICACID;γ-Pyrone-2-carboxylicacid;GAMMA-PYRONE-2-CARBOXYLICACID;4-OXO-4H-PYRAN-2-CARBOXYLICACID;4H-Pyran-2-carboxylicacid,4-oxo-;4-Oxo-4H-pyran-2-carboxylicAcidgamma-Pyrone-2-carboxylicAcid
Categories:
Chemical Reagents > Organic Reagents

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COMANICACID Basic Attributes

Molecular Weight：

140.094

Exact Mass：

140.010956

DSSTox ID：

DTXSID00486729

HScode：

2932999099

Characteristics

PSA：

67.51000

XLogP3：

-0.56

Density：

1.5±0.1 g/cm3

Melting Point：

253-254 °C

Boiling Point：

354.5±37.0 °C at 760 mmHg

Flash Point：

160.0±20.0 °C

Refractive Index：

1.577

Safety Information

hazard class code：

36/37/38

safety instructions：

26-36/37/39

Precautionary statement(s)：

P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:140.09
XLogP3:-0.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:140.01095860
Monoisotopic Mass:140.01095860
Topological Polar Surface Area:63.6
Heavy Atom Count:10
Complexity:236
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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