40018-25-5

Name 2-CHLOROBENZOYLACETONITRILE
CAS 40018-25-5
EINECS(EC#) 609-772-9
Molecular Formula C9H6ClNO
MDL Number MFCD00051624
Molecular Weight 179.6
MOL File 40018-25-5.mol

Chemical Properties

Appearance Yellowish Solid
Melting point  55-59 °C
Boiling point  302.2±22.0 °C(Predicted)
density  1.2364 (rough estimate)
refractive index  1.5330 (estimate)
storage temp.  Sealed in dry,Store in freezer, under -20°C
solubility  Chloroform (Slightly), Methanol (Slightly)
form  Solid
pka 6.41±0.10(Predicted)
color  Yellow to Dark Yellow
Sensitive  Moisture Sensitive
BRN  2413204
InChI InChI=1S/C9H6ClNO/c10-8-4-2-1-3-7(8)9(12)5-6-11/h1-4H,5H2
InChIKey SBSWHTFHLWSSQS-UHFFFAOYSA-N
SMILES C1(C=CC=CC=1Cl)C(=O)CC#N
LogP 0.8 at 30℃
CAS DataBase Reference 40018-25-5(CAS DataBase Reference)

Safety Data

Hazard Codes  Xn,T,Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
Safety Statements 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S22:Do not breathe dust .
RIDADR  3276
REACH Registrations Inactive
PackingGroup  III
HS Code  29269095

Hazard Information

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