sales@angenesci.com
Login | Register
logo
Structures Search
Home Carboxys 4-(Methoxycarbonyl)bicyclo[2.1.1]hexane-1-carboxylic acid

4-(Methoxycarbonyl)bicyclo[2.1.1]hexane-1-carboxylic acid

CAS No.:
141046-52-8
Catalog Number:
AG003AOH
Molecular Formula:
C9H12O4
Molecular Weight:
184.1892
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$714
- +
1g
95%
1 week
United States
$1424
- +
Product Description
Catalog Number:
AG003AOH
Chemical Name:
4-(Methoxycarbonyl)bicyclo[2.1.1]hexane-1-carboxylic acid
CAS Number:
141046-52-8
Molecular Formula:
C9H12O4
Molecular Weight:
184.1892
MDL Number:
MFCD20645009
IUPAC Name:
4-methoxycarbonylbicyclo[2.1.1]hexane-1-carboxylic acid
InChI:
InChI=1S/C9H12O4/c1-13-7(12)9-3-2-8(4-9,5-9)6(10)11/h2-5H2,1H3,(H,10,11)
InChI Key:
YXVUNUBFPAVHRP-UHFFFAOYSA-N
SMILES:
COC(=O)C12CCC(C1)(C2)C(=O)O
Properties
Complexity:
275  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.074g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
184.191g/mol
Monoisotopic Mass:
184.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties