TFA-ap-dC

CAT: 0127-PC110588-03Size: 5 gDry Ice: NoHazardous: No

1 / 1

CAT#:0127-PC110588-03Size:5 g

Selected

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

Quick Request Actions

CAS Number

115899-38-2

Purity

97%

Smiles

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

Chemical Information

TFA-ap-dC

CAS Number	115899-38-2
PubChem CID	14768553
IUPAC Name	N-[3-[4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-5-yl]prop-2-ynyl]-2,2,2-trifluoroacetamide
Molecular Formula	C14H15F3N4O5
Molecular Weight	376.29
XLogP	-1.1
Topological Polar Surface Area	137
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	4
Heavy Atom Count	26
Formal Charge	0
Complexity	721

SMILES

C1[C@@H]([C@H](O[C@H]1N2C=C(C(=NC2=O)N)C#CCNC(=O)C(F)(F)F)CO)O

InChI

InChI=1S/C14H15F3N4O5/c15-14(16,17)12(24)19-3-1-2-7-5-21(13(25)20-11(7)18)10-4-8(23)9(6-22)26-10/h5,8-10,22-23H,3-4,6H2,(H,19,24)(H2,18,20,25)/t8-,9+,10+/m0/s1

InChIKey

OKLUSVKQOCPUNW-IVZWLZJFSA-N

Chemical Structure

2D Structure

CAS: 115899-38-2

CID: 14768553

Formula: C14H15F3N4O5

MW: 376.29

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	376.29
XLogP3	-1.1
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	4
Exact Mass	376.09945408
Monoisotopic Mass	376.09945408
Topological Polar Surface Area	137 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	721
Isotope Atom Count	0
Defined Atom Stereocenter Count	3
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
PC1001056	TFA-ap-dU
PC109981	7-TFA-ap-7-Deaza-dA
PC109982	7-TFA-ap-7-Deaza-dG
BUP08887-01	DC-S239
BUP05120-01	DC 07090
BUP08423-01	DC-05
BUP16216-01	DC-TEADin02
BUP23575-01	Neurokinin A TFA
BUP21680	EZM0414 TFA
BUP20577-01	Traxanox TFA

Alternative Products

Catalog	Name
NT57548-01	TFA-aa-dC
NT57540-01	2'-TFA-NH-dC
NT57551-01	TFA-ap-dU
26-6920-10	AP-dC 10 umol scale
26-6920-03	AP-dC 2 umol scale
26-6920-06	AP-dC 5 umol scale
26-6920-01	AP-dC 1 umol scale
26-6920-02	AP-dC 200 nmol scale
26-6920-25	AP-dC 25 nmol scale
26-6920-15	AP-dC 15 umol scale

TFA-ap-dC

Chemical Information

Related Products

Alternative Products

Popular Products