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313701-79-0

313701-79-0 structural image
Product Name: 2-CHLORO-4-(2,5-DIMETHYL-PYRROL-1-YL)-BENZOIC ACID
Formula: C13H12ClNO2
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SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Corrosion
Corrosives
GHS05
GHS Hazard Statements H315:Skin corrosion/irritation
H318:Serious eye damage/eye irritation
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:IF ON SKIN: wash with plenty of soap and water.
P332+P313:IF SKIN irritation occurs: Get medical advice/attention.

COMPUTED DESCRIPTORS

Molecular Weight 249.69 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 249.0556563 g/mol
Monoisotopic Mass 249.0556563 g/mol
Topological Polar Surface Area 42.2 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 287
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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