2-Bromo-5- (2-methoxyethoxy) pyrazine

CAT: 0127-OR1067856-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1067856-01Size:50 mg

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CAS Number

1351523-79-9

MDL Number

MFCD28671504

Purity

98%

Smiles

COCCOC1=CN=C(Br)C=N1

Chemical Information

2-Bromo-5-(2-methoxyethoxy)pyrazine

CAS Number	1351523-79-9
PubChem CID	86690871
IUPAC Name	2-bromo-5-(2-methoxyethoxy)pyrazine
Molecular Formula	C7H9BrN2O2
Molecular Weight	233.06
XLogP	1
Topological Polar Surface Area	44.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	12
Formal Charge	0
Complexity	126

SMILES

COCCOC1=CN=C(C=N1)Br

InChI

InChI=1S/C7H9BrN2O2/c1-11-2-3-12-7-5-9-6(8)4-10-7/h4-5H,2-3H2,1H3

InChIKey

VLRPMRIKPZZZMT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1351523-79-9

CID: 86690871

Formula: C7H9BrN2O2

MW: 233.06

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	233.06
XLogP3	1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	231.98474
Monoisotopic Mass	231.98474
Topological Polar Surface Area	44.2 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	126
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

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