2'-O-Propargylcytidine

CAT: 0013-GTR19279814-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19279814-01Size:10 mg

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Description

2'-O-Propargylcytidine is a monomeric material used in nucleic acid synthesis.

CAS Number

206552-85-4

Smiles

O (CC#C) [C@H]1[C@@H] (O[C@H] (CO) [C@H]1O) N2C (=O) N=C (N) C=C2

Molecular Formula

C12H15N3O5

Molecular Weight

281.27

Notes

For research use only.

Chemical Information

2'-o-Propargylcytidine

CAS Number	206552-85-4
PubChem CID	22885208
IUPAC Name	4-amino-1-[(2R,3R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-prop-2-ynoxyoxolan-2-yl]pyrimidin-2-one
Molecular Formula	C12H15N3O5
Molecular Weight	281.26
XLogP	-1.5
Topological Polar Surface Area	118
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Heavy Atom Count	20
Formal Charge	0
Complexity	495

SMILES

C#CCO[C@@H]1[C@@H]([C@H](O[C@H]1N2C=CC(=NC2=O)N)CO)O

InChI

InChI=1S/C12H15N3O5/c1-2-5-19-10-9(17)7(6-16)20-11(10)15-4-3-8(13)14-12(15)18/h1,3-4,7,9-11,16-17H,5-6H2,(H2,13,14,18)/t7-,9-,10-,11-/m1/s1

InChIKey

FJGRSBJPLPTKDE-QCNRFFRDSA-N

Chemical Structure

2D Structure

CAS: 206552-85-4

CID: 22885208

Formula: C12H15N3O5

MW: 281.26

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	281.26
XLogP3	-1.5
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Exact Mass	281.10117059
Monoisotopic Mass	281.10117059
Topological Polar Surface Area	118 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	495
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Catalog	Name
HY-W969826	2'-O-Propargylcytidine
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