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2-Thiouracil

CAT: 0286-T11915-01Size: 100 gDry Ice: NoHazardous: No
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CAT#:0286-T11915-01Size:100 g
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CAS Number
141-90-2
Pictogram
07 - Irritant; 09 - Environmental hazard
UDF Signal Word
Warning
MDL Number
MFCD00006039
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H320 Causes eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation; H411 Toxic to aquatic life with long-lasting effects.
DOT Name
Not D.O.T.-Regulated
Precautions
P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P273 Avoid release to the environment; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

Thiouracil

Thiouracil can cause cancer according to The World Health Organization's International Agency for Research on Cancer (IARC).

CAS Number141-90-2
PubChem CID1269845
IUPAC Name2-sulfanylidene-1H-pyrimidin-4-one
Molecular FormulaC4H4N2OS
Molecular Weight128.15
XLogP-0.3
Topological Polar Surface Area73.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity163
SMILES
C1=CNC(=S)NC1=O
InChI
InChI=1S/C4H4N2OS/c7-3-1-2-5-4(8)6-3/h1-2H,(H2,5,6,7,8)
InChIKey
ZEMGGZBWXRYJHK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Thiouracil
CAS: 141-90-2
CID: 1269845
Formula: C4H4N2OS
MW: 128.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight128.15
XLogP3-0.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass128.00443393
Monoisotopic Mass128.00443393
Topological Polar Surface Area73.2 Ų
Heavy Atom Count8
Formal Charge0
Complexity163
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
TRC-T375400-100G2-Thiouracil

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