1,5-Diazabicyclo[4.3.0]non-5-ene

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Catalog Number
ACM3001727
Product Name
1,5-Diazabicyclo[4.3.0]non-5-ene
Structure
Structure
CAS
3001-72-7
Category
Heterocyclic Organic Compound
IUPAC Name
2,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrimidine
Molecular Weight
124.18g/mol
Molecular Formula
C7H12N2
Canonical SMILES
C1CC2=NCCCN2C1
InChI
InChI=1S/C7H12N2/c1-3-7-8-4-2-6-9(7)5-1/h1-6H2
InChI Key
SGUVLZREKBPKCE-UHFFFAOYSA-N
Complexity
140
Covalently-Bonded Unit Count
1
Exact Mass
124.100048g/mol
Formal Charge
0
H-Bond Acceptor
1
H-Bond Donor
0
Heavy Atom Count
9
LogP
-0.17 (LogP)
Monoisotopic Mass
124.100048g/mol
NSC Number
118106
Rotatable Bond Count
0
UNII
978M4OL12Q
XLogP3
-0.2
MSDS
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COA
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Spec Sheet
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