5-Bromo-2-ethylpyrimidine

CAT: 0127-OR1067970-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1067970-01Size:100 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

873331-73-8

MDL Number

MFCD14707237

Purity

98%

Smiles

BrC1=CN=C(N=C1)CC

Chemical Information

5-Bromo-2-ethylpyrimidine

CAS Number	873331-73-8
PubChem CID	25150069
IUPAC Name	5-bromo-2-ethylpyrimidine
Molecular Formula	C6H7BrN2
Molecular Weight	187.04
XLogP	1.7
Topological Polar Surface Area	25.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	9
Formal Charge	0
Complexity	79

SMILES

CCC1=NC=C(C=N1)Br

InChI

InChI=1S/C6H7BrN2/c1-2-6-8-3-5(7)4-9-6/h3-4H,2H2,1H3

InChIKey

SQOJDBHJUUGQJP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 873331-73-8

CID: 25150069

Formula: C6H7BrN2

MW: 187.04

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	187.04
XLogP3	1.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	185.97926
Monoisotopic Mass	185.97926
Topological Polar Surface Area	25.8 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	79.1
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
OR11580-01	5-Bromo-4-ethylpyrimidine
OR2912-01	2-Chloro-5-ethylpyrimidine
OR919228	Ethyl 2-ethylpyrimidine-5-carboxylate
OR43523-01	2,4-Dichloro-5-ethylpyrimidine
OR930977	2-Ethylpyrimidine-5-carboxylic acid
OR43606	5-Bromo-2-ethynylpyrimidine
OR315121-01	5-Bromo-2-ethylpyridine
OR302216-01	2-Bromo-5-ethylpyridine
OR1046335-01	2,4,6-Trichloro-5-ethylpyrimidine
OR91056-01	2-Amino-4,6-dichloro-5-ethylpyrimidine

Catalog	Name
435378-01	5-Bromo-2-ethylpyrimidine
sc-299765	5-Bromo-4-ethylpyrimidine
RFA60227-01	5-Bromo-4-chloro-6-ethylpyrimidine
abx188227	2-Chloro-5-Ethylpyrimidine
274817-01	2-Ethylpyrimidine-5-carbaldehyde
LTB38207-01	4-Bromo-6-ethylpyrimidine
XCA79016-01	2-Ethylpyrimidine-5-carboxylic acid
420129-01	2,4-Dichloro-5-ethylpyrimidine
sc-278443	6-amino-5-bromo-1-ethylpyrimidine-2,4 (1H,3H) -dione
267647-01	4-Chloro-5-ethylpyrimidine