CAS 39878-87-0|(R)-(-)-2-Phenylglycine chloride hydrochloride|(2R)-2-amino-2-phenylacetyl chloride hydrochloride|(2R)-2-amino-2-phenylacetyl chloride hydrochloride|D-(-)-α-苯甘氨酰氯盐酸盐|D-(-)-...

General Information

Structure

Molecular Formula

C₈H₉Cl₂NO

Molecular Mass

206.06916

Exact Mass

205.00611927

Charge

InChI

InChI=1S/C8H8ClNO.ClH/c9-8(11)7(10)6-4-2-1-3-5-6;/h1-5,7H,10H2;1H/t7-;/m1./s1

InChIKey

GVVFCAFBYHYGEE-OGFXRTJISA-N

Canonic Smiles

N[C@H](c1ccccc1)C(=O)Cl.Cl

Isomeric Smiles

C(=O)([C@H](N)c1ccccc1)Cl.Cl

Calculated Properties

JChem

Acid pKa

17.237165

H Acceptors

H Donor

LogD (pH = 5.5)

0.60595113

LogD (pH = 7.4)

1.299802

Log P

1.3222835

Molar Refractivity

44.2198

Polarizability

17.466106

Polar Surface Area

43.09

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Synonyms

(R)-(-)-2-Phenylglycine chloride hydrochlorideD-(-)-α-苯甘氨酰氯盐酸盐D-(-)-α-Phenylglycine chloride hydrochloride(R)-α-Aminophenylacetyl chloride hydrochloride(R)-α-氨基苯基乙酰氯盐酸盐D-(-)-α-Phenylglycine chloride hydrochloride(R)-2-Amino-2-phenylacetyl chloride hydrochloride(R)-(-)-2-苯甘氨酰氯盐酸盐D-(-)-α-苯甘氨酰氯盐酸盐(R)-(-)-2-Phenylglycine chloride hydrochloride

IUPAC Traditional name

(2R)-2-amino-2-phenylacetyl chloride hydrochloride

IUPAC name

(2R)-2-amino-2-phenylacetyl chloride hydrochloride

Names and Identifiers

Registration numbers

Beilstein Number

5405183

EC Number

254-668-5

CAS Number

39878-87-0