2-Iodo-5-methylpyrimidine

CAT: 0926-FI164823Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0926-FI164823Size:250 mg

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CAS Number

154129-30-3

MDL Number

MFCD12406105

Smiles

CC1=CN=C (N=C1) I

Molecular Formula

C5H5IN2

Molecular Weight

220.01 g/mol

Controlled

Chemical Information

2-Iodo-5-methylpyrimidine

CAS Number	154129-30-3
PubChem CID	45789621
IUPAC Name	2-iodo-5-methylpyrimidine
Molecular Formula	C5H5IN2
Molecular Weight	220.01
XLogP	1.3
Topological Polar Surface Area	25.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	8
Formal Charge	0
Complexity	68

SMILES

CC1=CN=C(N=C1)I

InChI

InChI=1S/C5H5IN2/c1-4-2-7-5(6)8-3-4/h2-3H,1H3

InChIKey

PKPRQEHDJNWUHR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 154129-30-3

CID: 45789621

Formula: C5H5IN2

MW: 220.01

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	220.01
XLogP3	1.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	219.94975
Monoisotopic Mass	219.94975
Topological Polar Surface Area	25.8 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	68.8
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
XHC60627-01	5-Iodo-2-methylpyrimidine
KCD02853-01	2-Cyclopropyl-5-iodo-4-methylpyrimidine
LEA07917-01	4-chloro-5-iodo-2-methylpyrimidine
KAC85919-01	5-Bromo-2-iodo-4-methylpyrimidine
JDA58649-01	4-Iodo-2-methylpyrimidine
PHA81094-01	5-Iodo-6-methylpyrimidine-2,4-diamine
SKC86366-01	4-Chloro-2-cyclopropyl-5-iodo-6-methylpyrimidine
DFC86535-01	4-Iodo-6-methylpyrimidine
FB140480	2-Bromo-5-methylpyrimidine
FC142315	5-Chloro-2-methylpyrimidine

Catalog	Name
OR93272-01	5-Chloro-2-iodo-4-methylpyrimidine
OR1046020-01	5-Bromo-2-iodo-4-methylpyrimidine
OR62052	5-Iodo-6-methylpyrimidine-2,4-diamine
OR86703-01	4,6-Dichloro-5-iodo-2-methylpyrimidine
OR76817-01	4-Chloro-5-iodo-6-methylpyrimidine
OR62053-01	2-Amino-4-chloro-5-iodo-6-methylpyrimidine
OR43601-01	4-Chloro-5-iodo-6-hydroxy-2-methylpyrimidine
430294-01	4-Amino-6-iodo-2-methylpyrimidine
OR1004622	5-Iodo-6-methylpyrimidine-2,4 (1H,3H) -dione
902013	5‐BROMO‐2‐METHYLPYRIMIDINE