Home Other Building Blocks 2-O-TOLYL-AZEPANE

2-O-TOLYL-AZEPANE

CAS No.:
133745-39-8
Catalog Number:
AG009HT4
Molecular Formula:
C13H19N
Molecular Weight:
189.2967
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$402
- +
5g
1 week
United States
$1766
- +
10g
1 week
United States
$2975
- +
Product Description
Catalog Number:
AG009HT4
Chemical Name:
2-O-TOLYL-AZEPANE
CAS Number:
133745-39-8
Molecular Formula:
C13H19N
Molecular Weight:
189.2967
MDL Number:
MFCD02663754
IUPAC Name:
2-(2-methylphenyl)azepane
InChI:
InChI=1S/C13H19N/c1-11-7-4-5-8-12(11)13-9-3-2-6-10-14-13/h4-5,7-8,13-14H,2-3,6,9-10H2,1H3
InChI Key:
CIBNCGKWGANWBA-UHFFFAOYSA-N
SMILES:
Cc1ccccc1C1CCCCCN1
Properties
Complexity:
167  
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