Home Other Building Blocks 1,9-DIOXASPIRO[5.5]UNDECANE-4-CARBOXYLIC ACID

1,9-DIOXASPIRO[5.5]UNDECANE-4-CARBOXYLIC ACID

CAS No.:
1520699-87-9
Catalog Number:
AG01DSTK
Molecular Formula:
C10H16O4
Molecular Weight:
200.2316
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Product Description
Catalog Number:
AG01DSTK
Chemical Name:
1,9-DIOXASPIRO[5.5]UNDECANE-4-CARBOXYLIC ACID
CAS Number:
1520699-87-9
Molecular Formula:
C10H16O4
Molecular Weight:
200.2316
MDL Number:
MFCD23792810
IUPAC Name:
1,9-dioxaspiro[5.5]undecane-4-carboxylic acid
InChI:
InChI=1S/C10H16O4/c11-9(12)8-1-4-14-10(7-8)2-5-13-6-3-10/h8H,1-7H2,(H,11,12)
InChI Key:
DTECNWOKJOJNBB-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCOC2(C1)CCOCC2
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.105g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
200.234g/mol
Monoisotopic Mass:
200.105g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties