Home Other Building Blocks [(3S)-3,4-dihydro-1H-2-benzopyran-3-yl]methanol

[(3S)-3,4-dihydro-1H-2-benzopyran-3-yl]methanol

CAS No.:
2031242-47-2
Catalog Number:
AG01BUYA
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
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Product Description
Catalog Number:
AG01BUYA
Chemical Name:
[(3S)-3,4-dihydro-1H-2-benzopyran-3-yl]methanol
CAS Number:
2031242-47-2
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
MDL Number:
MFCD30345316
IUPAC Name:
3,4-dihydro-1H-isochromen-3-ylmethanol
InChI:
InChI=1S/C10H12O2/c11-6-10-5-8-3-1-2-4-9(8)7-12-10/h1-4,10-11H,5-7H2
InChI Key:
FCNRRGSWSVZQKB-UHFFFAOYSA-N
SMILES:
OC[C@H]1OCc2c(C1)cccc2
Properties
Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.084g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
164.204g/mol
Monoisotopic Mass:
164.084g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties