Home Other Building Blocks (4S)-6-ethyl-3,4-dihydro-2H-1-benzopyran-4-ol

(4S)-6-ethyl-3,4-dihydro-2H-1-benzopyran-4-ol

CAS No.:
1567875-21-1
Catalog Number:
AG01AC21
Molecular Formula:
C11H14O2
Molecular Weight:
178.2277
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Product Description
Catalog Number:
AG01AC21
Chemical Name:
(4S)-6-ethyl-3,4-dihydro-2H-1-benzopyran-4-ol
CAS Number:
1567875-21-1
Molecular Formula:
C11H14O2
Molecular Weight:
178.2277
MDL Number:
MFCD21295430
IUPAC Name:
6-ethyl-3,4-dihydro-2H-chromen-4-ol
InChI:
InChI=1S/C11H14O2/c1-2-8-3-4-11-9(7-8)10(12)5-6-13-11/h3-4,7,10,12H,2,5-6H2,1H3
InChI Key:
VBYFSLDMGVADKA-UHFFFAOYSA-N
SMILES:
CCc1ccc2c(c1)[C@@H](O)CCO2
Properties
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.099g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
178.231g/mol
Monoisotopic Mass:
178.099g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties