5-Chloro-2-ethoxypyrimidine

CAT: 0926-PBC38643-01Size: 0.5 gDry Ice: NoHazardous: No

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CAT#:0926-PBC38643-01Size:0.5 g

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CAS Number

1289386-43-1

MDL Number

MFCD18837176

Smiles

CCOC1=NC=C (C=N1) Cl

Molecular Formula

C6H7ClN2O

Molecular Weight

158.58 g/mol

Controlled

Chemical Information

5-Chloro-2-ethoxypyrimidine

CAS Number	1289386-43-1
PubChem CID	23394007
IUPAC Name	5-chloro-2-ethoxypyrimidine
Molecular Formula	C6H7ClN2O
Molecular Weight	158.58
XLogP	1.5
Topological Polar Surface Area	35
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	10
Formal Charge	0
Complexity	93

SMILES

CCOC1=NC=C(C=N1)Cl

InChI

InChI=1S/C6H7ClN2O/c1-2-10-6-8-3-5(7)4-9-6/h3-4H,2H2,1H3

InChIKey

NEJKLBJNRWKKFV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1289386-43-1

CID: 23394007

Formula: C6H7ClN2O

MW: 158.58

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	158.58
XLogP3	1.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	158.0246905
Monoisotopic Mass	158.0246905
Topological Polar Surface Area	35 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	93.7
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
PBC00572	5-bromo-2-chloro-4-ethoxypyrimidine
IDA77409-01	2-Chloro-4-ethoxypyrimidine
SAA75811	5-Bromo-2-ethoxypyrimidine
MMA26349-01	2-Ethoxypyrimidine-5-carbaldehyde
BEC76211-01	2,5-Dichloro-4-ethoxypyrimidine
FD143382-01	2,4-Dichloro-5-ethoxypyrimidine
GJB85148	2-Chloro-5-ethoxypyridine
AHC84280-01	3-Chloro-5-ethoxypyridine-2-carboxylic acid
CCA31150	2-chloro-4-ethoxypyridine
TTA07502-01	2-Chloro-5- (trifluoromethoxy) benzaldehyde@2-chloro-5- (trifluoromethoxy) benzaldehyde

Catalog	Name
OR924684-01	2-Chloro-5-ethoxypyrimidine
RG-E141696-01	2-Chloro-4-ethoxypyrimidine
OR1065481-01	4-Chloro-2-ethoxypyrimidine
OR94247	5-Bromo-2-chloro-4-ethoxypyrimidine
OR1021239	2-Bromo-5-ethoxypyrimidine
OR1091818	2-Ethoxypyrimidine-5-carbaldehyde
abx183682-01	5-Bromo-2-ethoxypyrimidine
417548-01	2-Ethoxypyrimidine-5-boronic Acid
OR525616-01	2,4-Dichloro-5-ethoxypyrimidine
OR1096597	2-Ethoxypyrimidine-5-carboxylic acid