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58454-07-2

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58454-07-2 Structure

58454-07-2 Structure
IdentificationBack Directory
[Name]

CAPROIC ACID-1-13C
[CAS]

58454-07-2
[Synonyms]

Hexanoic Acid-13C
CAPROIC ACID-1-13C
HEXANOIC-1-13C ACID
Hexanoic Acid-1-13C
HEXANOIC-1-13C ACID, 99 ATOM % 13C
[Molecular Formula]

C6H12O2
[MDL Number]

MFCD00190321
[MOL File]

58454-07-2.mol
[Molecular Weight]

117.17
Chemical PropertiesBack Directory
[Melting point ]

−3 °C(lit.)
[Boiling point ]

202-203 °C(lit.)
[density ]

0.935 g/mL at 25 °C
[refractive index ]

n20/D 1.416(lit.)
[Fp ]

220 °F(lit.)
[InChI]

1S/C6H12O2/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H,7,8)/i6+1
[InChIKey]

FUZZWVXGSFPDMH-PTQBSOBMSA-N
[SMILES]

CCCCC[13C](O)=O
[CAS Number Unlabeled]

142-62-1
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictogramsGHS hazard pictograms
GHS05,GHS06
[Signal word ]

Danger
[Hazard statements ]

H302-H311-H331-H314
[Precautionary statements ]

P261-P271-P304+P340-P311-P321-P403+P233-P405-P501-P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501-P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P361-P363-P405-P501
[Hazard Codes ]

C,T
[Risk Statements ]

20/21/22-34-23/24-22
[Safety Statements ]

23-26-27-36/37/39-45
[RIDADR ]

UN 2829 8/PG 3
[WGK Germany ]

3
[Storage Class]

8A - Combustible corrosive hazardous materials
[Hazard Classifications]

Eye Dam. 1
Skin Corr. 1C
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