Molecular Weight:135.16316 [g/mol]
Molecular Formula:C8H9NO
XLogP3:0.5
H-Bond Donor:1
H-Bond Acceptor:1
Rotatable Bond Count:2
Tautomer Count:3
Exact Mass:135.068414
MonoIsotopic Mass:135.068414
Topological Polar Surface Area:43.1
Heavy Atom Count:10
Formal Charge:0
Complexity:116
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Donor Count:1
Feature 3D Ring Count:1
Effective Rotor Count:2
Conformer Sampling RMSD:0.4
CID Conformer Count:15
Safety and Handling
【Hazard Codes】
Xi
【Safety Statements 】
S22;S24/25
【HazardClass】
IRRITANT
【Hazard Note】
Irritant
【Safety】
Moderately toxic by intraperitoneal route. When heated to decomposition it emits toxic fumes of NOx.
Hazard Codes: Xi
Safety Statements: 22-24/25
S22:Do not breathe dust.
S24/25:Avoid contact with skin and eyes.
RTECS: AC7705000
Hazard Note: Irritant
【PackingGroup 】
Z01
【Transport】
【Specification】
2-Phenylacetamide , its cas register number is 103-81-1. It also can be called Phenyl-beta-acetylamine ; Phenylacetic acid amide ; alpha-Phenylacetamide ; alpha-Toluamide ; alpha-Toluimidic acid .