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1616526-84-1 | 2H-1-Benzopyran-4-ol, 3,4-dihydro-5-methoxy-
CAS No: 1616526-84-1 Catalog No: AG001VRQ MDL No:MFCD27921584
Product Description
Catalog Number:
AG001VRQ
Chemical Name:
2H-1-Benzopyran-4-ol, 3,4-dihydro-5-methoxy-
CAS Number:
1616526-84-1
Molecular Formula:
C10H12O3
Molecular Weight:
180.2005
MDL Number:
MFCD27921584
IUPAC Name:
5-methoxy-3,4-dihydro-2H-chromen-4-ol
InChI:
InChI=1S/C10H12O3/c1-12-8-3-2-4-9-10(8)7(11)5-6-13-9/h2-4,7,11H,5-6H2,1H3
InChI Key:
DRMDNZOIPVJFPN-UHFFFAOYSA-N
SMILES:
COc1cccc2c1C(O)CCO2
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.203g/mol
Monoisotopic Mass:
180.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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