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Uramustine 10mg

CAT: 0628-A13473-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0628-A13473-10Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
66-75-1

Chemical Information

Uracil Mustard

Uracil Mustard can cause cancer according to an independent committee of scientific and health experts. It can cause developmental toxicity, female reproductive toxicity and male reproductive toxicity according to state or federal government labeling requirements.

CAS Number66-75-1
PubChem CID6194
IUPAC Name5-[bis(2-chloroethyl)amino]-1H-pyrimidine-2,4-dione
Molecular FormulaC8H11Cl2N3O2
Molecular Weight252.09
XLogP0.5
Topological Polar Surface Area61.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count15
Formal Charge0
Complexity288
SMILES
C1=C(C(=O)NC(=O)N1)N(CCCl)CCCl
InChI
InChI=1S/C8H11Cl2N3O2/c9-1-3-13(4-2-10)6-5-11-8(15)12-7(6)14/h5H,1-4H2,(H2,11,12,14,15)
InChIKey
IDPUKCWIGUEADI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Uracil Mustard
CAS: 66-75-1
CID: 6194
Formula: C8H11Cl2N3O2
MW: 252.09
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight252.09
XLogP30.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass251.0228320
Monoisotopic Mass251.0228320
Topological Polar Surface Area61.4 Ų
Heavy Atom Count15
Formal Charge0
Complexity288
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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