Rizatriptan Impurity 16

CAT: 1299-RM-R260116-02Size: 25 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-R260116-02Size:25 mg

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

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CAS Number

3179-63-3

Synonyms

3- (dimethylamino) propan-1-ol

Molecular Formula

C5H13NO

Molecular Weight

103.17

Target Alternative Name

Rizatriptan

Product Name Synonym

3- (dimethylamino) propan-1-ol

Chemical Information

3-(Dimethylamino)-1-propanol

dimethylamine precursor

CAS Number	3179-63-3
PubChem CID	76646
IUPAC Name	3-(dimethylamino)propan-1-ol
Molecular Formula	C5H13NO
Molecular Weight	103.16
XLogP	-0.1
Topological Polar Surface Area	23.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	7
Formal Charge	0
Complexity	37

SMILES

CN(C)CCCO

InChI

InChI=1S/C5H13NO/c1-6(2)4-3-5-7/h7H,3-5H2,1-2H3

InChIKey

PYSGFFTXMUWEOT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 3179-63-3

CID: 76646

Formula: C5H13NO

MW: 103.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	103.16
XLogP3	-0.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	103.099714038
Monoisotopic Mass	103.099714038
Topological Polar Surface Area	23.5 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	37.1
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