Home Other Building Blocks 4-methyl-4-phenylazepane

4-methyl-4-phenylazepane

CAS No.:
933743-33-0
Catalog Number:
AG01B9R8
Molecular Formula:
C13H19N
Molecular Weight:
189.2967
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Product Description
Catalog Number:
AG01B9R8
Chemical Name:
4-methyl-4-phenylazepane
CAS Number:
933743-33-0
Molecular Formula:
C13H19N
Molecular Weight:
189.2967
MDL Number:
MFCD20690295
IUPAC Name:
4-methyl-4-phenylazepane
InChI:
InChI=1S/C13H19N/c1-13(8-5-10-14-11-9-13)12-6-3-2-4-7-12/h2-4,6-7,14H,5,8-11H2,1H3
InChI Key:
XROKUYOSRDIQDC-UHFFFAOYSA-N
SMILES:
CC1(CCNCCC1)c1ccccc1
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.152g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.302g/mol
Monoisotopic Mass:
189.152g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties