ETHYL NICOTINATE-1,2',3',4',5',6'-13C6

CAS No.
1246819-16-8
CCD No.
CCD00443498
Formula
C8 H9 N O2
MolWeight
157.098

Basic Information

Product Name: ETHYL NICOTINATE-1,2',3',4',5',6'-13C6
CAS: 1246819-16-8
English Synonyms: ETHYL NICOTINATE-13C6 ; ETHYL NICOTINATE-1,2',3',4',5',6'-13C6
MDL Number.: MFCD04039539
H bond acceptor: 3
H bond donor: 0
Smile: CCO[13C](=O)[13c]1[13cH][13cH][13cH]n[13cH]1
InChi: InChI=1S/C8H9NO2/c1-2-11-8(10)7-4-3-5-9-6-7/h3-6H,2H2,1H3/i3+1,4+1,5+1,6+1,7+1,8+1
InChiKey: InChIKey=XBLVHTDFJBKJLG-LSYAIDEBSA-N

Property

Melting Point: 8-10 DEG C
Boiling Point: 223-224 DEG C(LIT)
Physical Property: FLASHPOINT: 199.4 DEG F
FLASHPOINT: 93 DEG C
Comments: MASS SHIFT: M+6
WGK: 3
Information: ISOTOPIC PURITY: 99 ATOM % 13C
MW: 157.06 BY ATOM % CALCULATION

Safety information

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