Roxatidine Impurity 55

CAT: 1299-RM-R242255-02Size: 25 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-R242255-02Size:25 mg

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

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CAS Number

132284-19-6

Synonyms

2-hydroxy-N- (3-hydroxypropyl) acetamide

Molecular Formula

C5H11NO3

Molecular Weight

133.15

Target Alternative Name

Roxatidine

Product Name Synonym

2-hydroxy-N- (3-hydroxypropyl) acetamide

Chemical Information

2-hydroxy-N-(3-hydroxypropyl)acetamide

CAS Number	132284-19-6
PubChem CID	24284831
IUPAC Name	2-hydroxy-N-(3-hydroxypropyl)acetamide
Molecular Formula	C5H11NO3
Molecular Weight	133.15
XLogP	-1.4
Topological Polar Surface Area	69.6
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	9
Formal Charge	0
Complexity	84

SMILES

C(CNC(=O)CO)CO

InChI

InChI=1S/C5H11NO3/c7-3-1-2-6-5(9)4-8/h7-8H,1-4H2,(H,6,9)

InChIKey

GUBGTDFHAQAAKC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 132284-19-6

CID: 24284831

Formula: C5H11NO3

MW: 133.15

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	133.15
XLogP3	-1.4
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	133.07389321
Monoisotopic Mass	133.07389321
Topological Polar Surface Area	69.6 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	84.3
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