Home Carboxys Tricyclo[2.2.1.02,6]heptane-3-carboxylic acid, 5-oxo-,(1R,2S,3S,4S,6R)-rel-

Tricyclo[2.2.1.02,6]heptane-3-carboxylic acid, 5-oxo-,(1R,2S,3S,4S,6R)-rel-

CAS No.:
52730-40-2
Catalog Number:
AG00I9FH
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00I9FH
Chemical Name:
Tricyclo[2.2.1.02,6]heptane-3-carboxylic acid, 5-oxo-,(1R,2S,3S,4S,6R)-rel-
CAS Number:
52730-40-2
MDL Number:
MFCD00238753
IUPAC Name:
(1S,2R)-5-oxotricyclo[2.2.1.02,6]heptane-3-carboxylic acid
InChI:
InChI=1S/C8H8O3/c9-7-3-1-2-4(5(2)7)6(3)8(10)11/h2-6H,1H2,(H,10,11)/t2-,3?,4+,5?,6?/m0/s1
InChI Key:
YUOZAHBGIJALKD-DNNDZMEASA-N
Properties
Complexity:
271  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
152.047g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
152.149g/mol
Monoisotopic Mass:
152.047g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties