Home Carboxys 1-[(Benzyloxy)carbonyl]azepane-4-carboxylic acid

1-[(Benzyloxy)carbonyl]azepane-4-carboxylic acid

CAS No.:
1195256-01-9
Catalog Number:
AG000IXG
Molecular Formula:
C15H18NO4-
Molecular Weight:
276.3077
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$330
- +
1g
97%
1 week
United States
$913
- +
Product Description
Catalog Number:
AG000IXG
Chemical Name:
1-[(Benzyloxy)carbonyl]azepane-4-carboxylic acid
CAS Number:
1195256-01-9
Molecular Formula:
C15H18NO4-
Molecular Weight:
276.3077
MDL Number:
MFCD16658690
IUPAC Name:
1-phenylmethoxycarbonylazepane-4-carboxylic acid
InChI:
InChI=1S/C15H19NO4/c17-14(18)13-7-4-9-16(10-8-13)15(19)20-11-12-5-2-1-3-6-12/h1-3,5-6,13H,4,7-11H2,(H,17,18)
InChI Key:
JLWCNEUUHMLQAZ-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC(CC1)C(=O)[O-])OCc1ccccc1
Properties
Complexity:
339  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.131g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
277.32g/mol
Monoisotopic Mass:
277.131g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties