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6-n-Propyl-2-thiouracil 98%

CAT: 0286-P28100-01Size: 5 gDry Ice: NoHazardous: No
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CAT#:0286-P28100-01Size:5 g
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CAS Number
51-52-5
Synonyms
4-Hydroxy-2-mercapto-6-ropylpyrimidine; Procasil; Propacil; Propycil; 2-Thio-4-oxo-6-propyl-1,3-pyrimidine; 2-Thio-6-propyl-1,3-pyrimidin-4-one
Pictogram
07 - Irritant; 08 - Health Hazard
UDF Signal Word
Warning
MDL Number
MFCD00006041
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation; H351 Suspected of causing cancer; H361 Suspected of damaging fertility or the unborn child.
DOT Name
Not D.O.T.-Regulated
Precautions
P260 Do not breathe dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; 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; P314 Get medical advice/attention if you feel unwell; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

Propylthiouracil

Propylthiouracil can cause cancer according to an independent committee of scientific and health experts. It can cause developmental toxicity according to state or federal government labeling requirements.

CAS Number51-52-5
PubChem CID657298
IUPAC Name6-propyl-2-sulfanylidene-1H-pyrimidin-4-one
Molecular FormulaC7H10N2OS
Molecular Weight170.23
XLogP0.8
Topological Polar Surface Area73.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity222
SMILES
CCCC1=CC(=O)NC(=S)N1
InChI
InChI=1S/C7H10N2OS/c1-2-3-5-4-6(10)9-7(11)8-5/h4H,2-3H2,1H3,(H2,8,9,10,11)
InChIKey
KNAHARQHSZJURB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Propylthiouracil
CAS: 51-52-5
CID: 657298
Formula: C7H10N2OS
MW: 170.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight170.23
XLogP30.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass170.05138412
Monoisotopic Mass170.05138412
Topological Polar Surface Area73.2 Ų
Heavy Atom Count11
Formal Charge0
Complexity222
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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