CAS 700-63-0 2-Amino-2-phenylacetamide (HCID 12791)

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Basic information

CAS: 700-63-0
Standard SMILES: NC(=O)C(N)c1ccccc1
InChIKey: KIYRSYYOVDHSPG-UHFFFAOYSA-N
Molecular formula: C8H10N2O
Average molar mass: 150.18 g/mol

Names & identifiers

Preferred name: 2-Amino-2-phenylacetamide
IUPAC: 2-amino-2-phenylacetamide
English name: 2-amino-2-phenylacetamide
Molecular formula: C8H10N2O
Molecular weight: 150.18

Names & synonyms

2-Amino-2-phenylacetamideACETAMIDE, 2-AMINO-2-PHENYL-EINECS 211-849-3NSC 47695BRN 09724721-14-00-00592 (Beilstein Handbook Reference)RefChem:85086211-849-3KIYRSYYOVDHSPG-UHFFFAOYSA-N700-63-02-Amino-2-phenyl-acetamideDL-2-PHENYLGLYCINAMIDE

Show more names

PhenylglycinamidDL-PhenylglycinamideDL-Phenylglycine amideBenzeneacetaMide, a-aMino-Benzeneacetamide, α-amino-2-azanyl-2-phenyl-ethanamide

Benzeneacetamide, .alpha.-amino-MFCD00025498NSC47695DL-alpha-Phenylglycine amideH-Phg-NH HClaminophenylacetamideBenzeneacetamide, alpha-amino-2-Phenyl-2-aminoacetamide

Database identifiers

CAS: 700-63-0
PubChem CID: 12791
EC Number: 211-849-3
Nikkaji: J54.048J

Properties

Computed structural properties

XLogP: -0.1
Topological polar surface area: 69.1 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 11
Formal charge: 0
Complexity: 141

Physicochemical properties

Melting point: 130 · 130-131℃
Boiling point: 322.8 · 322.8±35.0 °C(Predicted)
Density: 1.178 · 1.178±0.06 g/cm3(Predicted)
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
solubility: DMSO (Sparingly, Heated, Sonicated), Methanol (Slightly)
form: Solid
pka: 15.61 · 15.61±0.50(Predicted)
color: White to Off-White
λmax: 254 nm · 254nm(lit.)
Symbol(GHS): 5 · GHS05
Signal word: Danger
Hazard statements: 314 · H314
Precautionary statements: 280 · P280-P305+P351+P338-P310
RTECS: 4390000 · AB4390000

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

rtecs: AB4390000
Signal word: Danger
Symbol(GHS): GHS05
Hazard statements: H314
Precautionary statements: P280-P305+P351+P338-P310

Chemistry & industry

Applications

UsesDL-2-Phenylglycinamide is used in the synthesis of enantiopure α-amino acids and amides. Also used in the preparation of HIV-1 reverse transcriptase inhibitors in the form of thiadiazole derivatives.