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2,2-Diphenylglycine

CAT: 0572-TRC-D491620-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-D491620-1GSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
3060-50-2
Synonyms
Phenytoin Sodium Imp. C (EP); Phenytoin Imp. C (EP); Phenytoin USP Related Compound A; Phenytoin USP RC A; Amino(diphenyl)acetic Acid; 2,2-Diphenylglycine; Phenytoin Related Compound A; Phenytoin Impurity C; Phenytoin Sodium Impurity C; Phenytoin Impurity C
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
NC(C(=O)O)(c1ccccc1)c2ccccc2
Molecular Formula
C14 H13 N O2
Molecular Weight
227.26
InChI
InChI=1S/C14H13NO2/c15-14(13(16)17,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,15H2,(H,16,17)
Additionnal Information
IUPAC name: 2-amino-2,2-diphenylacetic acid
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

2,2-Diphenylglycine

structure in first source

CAS Number3060-50-2
PubChem CID18289
IUPAC Name2-amino-2,2-diphenylacetic acid
Molecular FormulaC14H13NO2
Molecular Weight227.26
XLogP-1
Topological Polar Surface Area63.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count17
Formal Charge0
Complexity247
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)O)N
InChI
InChI=1S/C14H13NO2/c15-14(13(16)17,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,15H2,(H,16,17)
InChIKey
YBONNYNNFBAKLI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,2-Diphenylglycine
CAS: 3060-50-2
CID: 18289
Formula: C14H13NO2
MW: 227.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight227.26
XLogP3-1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass227.094628657
Monoisotopic Mass227.094628657
Topological Polar Surface Area63.3 Ų
Heavy Atom Count17
Formal Charge0
Complexity247
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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