Home Other Building Blocks 2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4,5-diol

2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4,5-diol

CAS No.:
100942-36-7
Catalog Number:
AG01BHRB
Molecular Formula:
C11H14O3
Molecular Weight:
194.2271
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Product Description
Catalog Number:
AG01BHRB
Chemical Name:
2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4,5-diol
CAS Number:
100942-36-7
Molecular Formula:
C11H14O3
Molecular Weight:
194.2271
MDL Number:
MFCD24714852
IUPAC Name:
2,2-dimethyl-3,4-dihydrochromene-4,5-diol
InChI:
InChI=1S/C11H14O3/c1-11(2)6-8(13)10-7(12)4-3-5-9(10)14-11/h3-5,8,12-13H,6H2,1-2H3
InChI Key:
CRULODLPSXBZGL-UHFFFAOYSA-N
SMILES:
OC1CC(C)(C)Oc2c1c(O)ccc2
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.094g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
194.23g/mol
Monoisotopic Mass:
194.094g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties