Tenofovir Impurity 304

CAT: 1299-RM-T140904-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-T140904-01Size:10 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

52364-31-5

Synonyms

Diphenyl (hydroxymethyl) phosphonate

Molecular Formula

C13H13O4P

Molecular Weight

264.22

Target Alternative Name

Tenofovir

Product Name Synonym

Diphenyl (hydroxymethyl) phosphonate

Chemical Information

Diphenyl (hydroxymethyl)phosphonate

CAS Number	52364-31-5
PubChem CID	14715646
IUPAC Name	diphenoxyphosphorylmethanol
Molecular Formula	C13H13O4P
Molecular Weight	264.21
XLogP	2.5
Topological Polar Surface Area	55.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Heavy Atom Count	18
Formal Charge	0
Complexity	259

SMILES

C1=CC=C(C=C1)OP(=O)(CO)OC2=CC=CC=C2

InChI

InChI=1S/C13H13O4P/c14-11-18(15,16-12-7-3-1-4-8-12)17-13-9-5-2-6-10-13/h1-10,14H,11H2

InChIKey

BGXICRHOOKQPMF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 52364-31-5

CID: 14715646

Formula: C13H13O4P

MW: 264.21

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	264.21
XLogP3	2.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	264.05514589
Monoisotopic Mass	264.05514589
Topological Polar Surface Area	55.8 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	259
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
Compound Is Canonicalized	Yes