OCTANOIC ACID-1,2,3,4-13C4

CAS No.
159118-65-7
CCD No.
CCD00096407
Formula
C8 H16 O2
MolWeight
148.168

Basic Information

Product Name: OCTANOIC ACID-1,2,3,4-13C4
CAS: 159118-65-7
English Synonyms: OCTANOIC ACID-1,2,3,4-13C4 ; CAPRYLIC ACID-1,2,3,4-13C4
MDL Number.: MFCD00209768
H bond acceptor: 2
H bond donor: 1
Smile: CCCC[13CH2][13CH2][13CH2][13C](=O)O
InChi: InChI=1S/C8H16O2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H,9,10)/i5+1,6+1,7+1,8+1
InChiKey: InChIKey=WWZKQHOCKIZLMA-WKHKRNGSSA-N

Property

Melting Point: 16 DEG C(LIT)
Boiling Point: 237 DEG C(LIT)
Density: DENSITY: 0.935 G/ML AT 25 DEG C
Physical Property: FLASHPOINT: 110 DEG C
FLASHPOINT: 230 DEG F
REFRACTIVE INDEX: N20/D 1.428(LIT)
Comments: ASSAY METHOD: CP
MASS SHIFT: M+4
RIDADR: UN 3265 8/PG 2
UNSPSC: 12142200
WGK: 1
Information: ISOTOPIC PURITY: 99 ATOM % 13C
MW: 148.16 BY ATOM % CALCULATION

Safety information

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