5- (Hydroxymethyl) -2-thiouracil

CAT: 0024-sc-262330Size: 1 gDry Ice: NoHazardous: No

1 / 1

CAT#:0024-sc-262330Size:1 g

Selected

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

Quick Request Actions

CAS Number

93185-31-0

Chemical Information

5-(Hydroxymethyl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one

CAS Number	93185-31-0
PubChem CID	2736582
IUPAC Name	5-(hydroxymethyl)-2-sulfanylidene-1H-pyrimidin-4-one
Molecular Formula	C5H6N2O2S
Molecular Weight	158.18
XLogP	-1.3
Topological Polar Surface Area	93.5
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	10
Formal Charge	0
Complexity	212

SMILES

C1=C(C(=O)NC(=S)N1)CO

InChI

InChI=1S/C5H6N2O2S/c8-2-3-1-6-5(10)7-4(3)9/h1,8H,2H2,(H2,6,7,9,10)

InChIKey

ANMAXDCIDVNRHA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 93185-31-0

CID: 2736582

Formula: C5H6N2O2S

MW: 158.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	158.18
XLogP3	-1.3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	158.01499861
Monoisotopic Mass	158.01499861
Topological Polar Surface Area	93.5 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	212
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

Catalog	Name
GTR19214785-01	5-Hydroxymethyl-2-thiouracil
OR4148	5- (Hydroxymethyl) -2-thiouracil
OR4149	6- (Hydroxymethyl) -2-thiouracil
IDA27886	2- (Hydroxymethyl) chroman
HY-78975-01	2- (Hydroxymethyl) -pyrimidine
HY-W563272	2- (Hydroxymethyl) cyclopropanecarbonitrile
422261	2α-Hydroxymethyl Ethisterone
418350	2-Hydroxymethyl Atomoxetiene
414252-01	2- (Hydroxymethyl) benzonitrile
TRC-H947110-500MG	2-(Hydroxymethyl)benzonitrile