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Home Carboxys 1-Boc-azepane-4-carboxylic acid

1-Boc-azepane-4-carboxylic acid

CAS No.:
868284-36-0
Catalog Number:
AG0036E1
Molecular Formula:
C12H21NO4
Molecular Weight:
243.2994
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$91
- +
250mg
95%
In Stock USA
United States
$166
- +
1g
95%
In Stock USA
United States
$333
- +
5g
95%
In Stock USA
United States
$1008
- +
Product Description
Catalog Number:
AG0036E1
Chemical Name:
1-Boc-azepane-4-carboxylic acid
CAS Number:
868284-36-0
Molecular Formula:
C12H21NO4
Molecular Weight:
243.2994
MDL Number:
MFCD10687156
IUPAC Name:
1-[(2-methylpropan-2-yl)oxycarbonyl]azepane-4-carboxylic acid
InChI:
InChI=1S/C12H21NO4/c1-12(2,3)17-11(16)13-7-4-5-9(6-8-13)10(14)15/h9H,4-8H2,1-3H3,(H,14,15)
InChI Key:
RZQHJTNUKFLYEA-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC(CC1)C(=O)O)OC(C)(C)C
Properties
Complexity:
295  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.147g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
243.303g/mol
Monoisotopic Mass:
243.147g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties