200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 138915-60-3
138915-60-3 | Bicyclo[7.3.1]trideca-4,9-diene-2,6-diyn-13-one, 1,8-dihydroxy-
CAS No: 138915-60-3 Catalog No: AG0019TY MDL No:
Product Description
Catalog Number:
AG0019TY
Chemical Name:
Bicyclo[7.3.1]trideca-4,9-diene-2,6-diyn-13-one, 1,8-dihydroxy-
CAS Number:
138915-60-3
Molecular Formula:
C13H10O3
Molecular Weight:
214.2167
IUPAC Name:
2,9-dihydroxybicyclo[7.3.1]trideca-1(12),5-dien-3,7-diyn-13-one
InChI:
InChI=1S/C13H10O3/c14-11-7-3-1-2-4-8-13(16)9-5-6-10(11)12(13)15/h1-2,6,11,14,16H,5,9H2
InChI Key:
NRSBQPLJKFSDJK-UHFFFAOYSA-N
SMILES:
OC1C#CC=CC#CC2(C(=O)C1=CCC2)O
Properties
Complexity:
527
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.063g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
214.22g/mol
Monoisotopic Mass:
214.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
1
XLogP3:
0.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.