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139-07-1

Name 1227
CAS 139-07-1
EINECS(EC#) 205-351-5
Molecular Formula C21H38ClN
MDL Number MFCD00137276
Molecular Weight 339.99
MOL File 139-07-1.mol
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Chemical Properties

Melting point  ~60 °C
Boiling point  162.7℃[at 101 325 Pa]
density  1.03[at 20℃]
vapor pressure  0Pa at 20℃
storage temp.  Sealed in dry,Room Temperature
solubility  866g/L in organic solvents at 20 ℃
form  Solid
color  White to Off-White
Water Solubility  2g/L at 20℃
BRN  3921689
Stability: Hygroscopic
InChI InChI=1S/C21H38N.ClH/c1-4-5-6-7-8-9-10-11-12-16-19-22(2,3)20-21-17-14-13-15-18-21;/h13-15,17-18H,4-12,16,19-20H2,1-3H3;1H/q+1;/p-1
InChIKey JBIROUFYLSSYDX-UHFFFAOYSA-M
SMILES C1(=CC=CC=C1)C[N+](C)(C)CCCCCCCCCCCC.[Cl-]
LogP 2.63
CAS DataBase Reference 139-07-1(CAS DataBase Reference)
EPA Substance Registry System 139-07-1(EPA Substance)

Safety Data

Hazard Codes  C,N
Risk Statements 
R21/22:Harmful in contact with skin and if swallowed .
R34:Causes burns.
R50:Very Toxic to aquatic organisms.
R50/53:Very Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
Safety Statements 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
S60:This material and/or its container must be disposed of as hazardous waste .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
RIDADR  UN 3261 8/PG 3
WGK Germany  2
RTECS  BO6821500
F  3-10
TSCA  Yes
HazardClass  8
PackingGroup  III
HS Code  29239000
Toxicity
LD50 oral in rat: 400mg/kg

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