Home Carboxys 1-Acetyl-2-methylazepane-2-carboxylic acid

1-Acetyl-2-methylazepane-2-carboxylic acid

CAS No.:
1159824-79-9
Catalog Number:
AG000HBX
Molecular Formula:
C10H17NO3
Molecular Weight:
199.2469
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$423
- +
1g
97%
1 week
United States
$1267
- +
Product Description
Catalog Number:
AG000HBX
Chemical Name:
1-Acetyl-2-methylazepane-2-carboxylic acid
CAS Number:
1159824-79-9
Molecular Formula:
C10H17NO3
Molecular Weight:
199.2469
MDL Number:
MFCD10687112
IUPAC Name:
1-acetyl-2-methylazepane-2-carboxylic acid
InChI:
InChI=1S/C10H17NO3/c1-8(12)11-7-5-3-4-6-10(11,2)9(13)14/h3-7H2,1-2H3,(H,13,14)
InChI Key:
GRBDSYXZRZQYFL-UHFFFAOYSA-N
SMILES:
CC(=O)N1CCCCCC1(C)C(=O)O
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.121g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
199.25g/mol
Monoisotopic Mass:
199.121g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties