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A a-Dichlorodiphenylmethane 95%

CAT: 0286-D14990-01Size: 25 gDry Ice: NoHazardous: No
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CAT#:0286-D14990-01Size:25 g
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CAS Number
2051-90-3
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00000811
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H320 Causes eye irritation; H332 Harmful if inhaled.
Precautions
P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

Dichlorodiphenylmethane
CAS Number2051-90-3
PubChem CID16327
IUPAC Name[dichloro(phenyl)methyl]benzene
Molecular FormulaC13H10Cl2
Molecular Weight237.12
XLogP4.5
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Heavy Atom Count15
Formal Charge0
Complexity169
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(Cl)Cl
InChI
InChI=1S/C13H10Cl2/c14-13(15,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
InChIKey
OPTDDWCXQQYKGU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dichlorodiphenylmethane
CAS: 2051-90-3
CID: 16327
Formula: C13H10Cl2
MW: 237.12
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight237.12
XLogP34.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Exact Mass236.0159557
Monoisotopic Mass236.0159557
Topological Polar Surface Area0 Ų
Heavy Atom Count15
Formal Charge0
Complexity169
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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