Home Other Building Blocks (3,4-dihydro-1H-2-benzopyran-7-yl)methanol

(3,4-dihydro-1H-2-benzopyran-7-yl)methanol

CAS No.:
1391113-48-6
Catalog Number:
AG01EMHS
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
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Product Description
Catalog Number:
AG01EMHS
Chemical Name:
(3,4-dihydro-1H-2-benzopyran-7-yl)methanol
CAS Number:
1391113-48-6
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
MDL Number:
MFCD22536222
IUPAC Name:
3,4-dihydro-1H-isochromen-7-ylmethanol
InChI:
InChI=1S/C10H12O2/c11-6-8-1-2-9-3-4-12-7-10(9)5-8/h1-2,5,11H,3-4,6-7H2
InChI Key:
KDVZVWNZPXLPEP-UHFFFAOYSA-N
SMILES:
OCc1ccc2c(c1)COCC2
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties