4- (5-Bromopyrazin-2-yl) morpholine

CAT: 0127-OR56782-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR56782-01Size:100 mg

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CAS Number

955050-08-5

MDL Number

MCD09878935

Purity

97%

Smiles

Brc1cnc(cn1)N2CCOCC2

Chemical Information

4-(5-Bromopyrazin-2-YL)morpholine

CAS Number	955050-08-5
PubChem CID	45787480
IUPAC Name	4-(5-bromopyrazin-2-yl)morpholine
Molecular Formula	C8H10BrN3O
Molecular Weight	244.09
XLogP	0.9
Topological Polar Surface Area	38.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Heavy Atom Count	13
Formal Charge	0
Complexity	163

SMILES

C1COCCN1C2=CN=C(C=N2)Br

InChI

InChI=1S/C8H10BrN3O/c9-7-5-11-8(6-10-7)12-1-3-13-4-2-12/h5-6H,1-4H2

InChIKey

KFJSCEYEZRTFOU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 955050-08-5

CID: 45787480

Formula: C8H10BrN3O

MW: 244.09

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	244.09
XLogP3	0.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	243.00072
Monoisotopic Mass	243.00072
Topological Polar Surface Area	38.3 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	163
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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