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Cyprodinil-d5

CAT: 1596-AR-C03854-02Size: 25 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-C03854-02Size:25 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1773496-67-5
Synonyms
4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine-D5; 4-Cyclopropyl-6-methyl-N-phenyl-2-pyrimidinamine-d5; CGA 219417-d5; Chorus 75WG-d5; Unix-d5; Vangard-d5
Molecular Formula
C14H10N3D5
Molecular Weight
230.33
API Name
Cyprodinil

Chemical Information

4-cyclopropyl-6-methyl-N-((2,3,4,5,6-2H5)phenyl)pyrimidin-2-amine
CAS Number1773496-67-5
PubChem CID131667689
IUPAC Name4-cyclopropyl-6-methyl-N-(2,3,4,5,6-pentadeuteriophenyl)pyrimidin-2-amine
Molecular FormulaC14H15N3
Molecular Weight230.32
XLogP3.1
Topological Polar Surface Area37.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count17
Formal Charge0
Complexity246
SMILES
[2H]C1=C(C(=C(C(=C1[2H])[2H])NC2=NC(=CC(=N2)C3CC3)C)[2H])[2H]
InChI
InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)/i2D,3D,4D,5D,6D
InChIKey
HAORKNGNJCEJBX-VIQYUKPQSA-N
Chemical Structure
2D Structure
2D structure of 4-cyclopropyl-6-methyl-N-((2,3,4,5,6-2H5)phenyl)pyrimidin-2-amine
CAS: 1773496-67-5
CID: 131667689
Formula: C14H15N3
MW: 230.32
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight230.32
XLogP33.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass230.157981221
Monoisotopic Mass230.157981221
Topological Polar Surface Area37.8 Ų
Heavy Atom Count17
Formal Charge0
Complexity246
Isotope Atom Count5
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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