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Benzyl (dimethyl) phosphane

CAT: 1266-JH631881Size: 1 EachDry Ice: NoHazardous: No
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CAS Number
13954-37-5
UN Code
UN 3146
Hazard Statement
Xi
Stability
Stable under normal temperatures and pressures.
Molecular Formula
C9H13P
Molecular Weight
152.17
Product Name Synonym
P, P-Dimethylbenzylphosphin
Physical Properties
White crystalline solid
Hazardous Class
6.1
Safety Statements
S24/25
Density
1.74 g/cm3
Flash Point
200.9oC
RIDADR
UN 3146
Melting Point
235-238oC

Chemical Information

Benzyl(dimethyl)phosphane
CAS Number13954-37-5
PubChem CID12463280
IUPAC Namebenzyl(dimethyl)phosphane
Molecular FormulaC9H13P
Molecular Weight152.17
XLogP1.9
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Heavy Atom Count10
Formal Charge0
Complexity82
SMILES
CP(C)CC1=CC=CC=C1
InChI
InChI=1S/C9H13P/c1-10(2)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
InChIKey
WTHDANPEBBZWQC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzyl(dimethyl)phosphane
CAS: 13954-37-5
CID: 12463280
Formula: C9H13P
MW: 152.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight152.17
XLogP31.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Exact Mass152.075487412
Monoisotopic Mass152.075487412
Topological Polar Surface Area0 Ų
Heavy Atom Count10
Formal Charge0
Complexity82.7
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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