Home Other Building Blocks 1-tert-butyl-1,4-diazepane

1-tert-butyl-1,4-diazepane

CAS No.:
1221722-15-1
Catalog Number:
AG01A7OU
Molecular Formula:
C9H20N2
Molecular Weight:
156.2685
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Product Description
Catalog Number:
AG01A7OU
Chemical Name:
1-tert-butyl-1,4-diazepane
CAS Number:
1221722-15-1
Molecular Formula:
C9H20N2
Molecular Weight:
156.2685
MDL Number:
MFCD14690000
IUPAC Name:
1-tert-butyl-1,4-diazepane
InChI:
InChI=1S/C9H20N2/c1-9(2,3)11-7-4-5-10-6-8-11/h10H,4-8H2,1-3H3
InChI Key:
NFTNAOZWHAOMPK-UHFFFAOYSA-N
SMILES:
CC(N1CCNCCC1)(C)C
Properties
Complexity:
115  
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:
1  
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties