Home Other Building Blocks 1-BUTYL-1,4-DIAZEPANE

1-BUTYL-1,4-DIAZEPANE

CAS No.:
3619-75-8
Catalog Number:
AG00C0L6
Molecular Formula:
C9H20N2
Molecular Weight:
156.2685
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Product Description
Catalog Number:
AG00C0L6
Chemical Name:
1-BUTYL-1,4-DIAZEPANE
CAS Number:
3619-75-8
Molecular Formula:
C9H20N2
Molecular Weight:
156.2685
MDL Number:
MFCD01312085
IUPAC Name:
1-butyl-1,4-diazepane
InChI:
InChI=1S/C9H20N2/c1-2-3-7-11-8-4-5-10-6-9-11/h10H,2-9H2,1H3
InChI Key:
GPWLJZCPRQGUMM-UHFFFAOYSA-N
SMILES:
CCCCN1CCNCCC1
Properties
Complexity:
93.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.163g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
156.273g/mol
Monoisotopic Mass:
156.163g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties