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20213-26-7 | 2H-Naphtho[1,2-b]pyran, 3,4-dihydro-6-methoxy-2,2-dimethyl-
CAS No: 20213-26-7 Catalog No: AG00282Y MDL No:
Product Description
Catalog Number:
AG00282Y
Chemical Name:
2H-Naphtho[1,2-b]pyran, 3,4-dihydro-6-methoxy-2,2-dimethyl-
CAS Number:
20213-26-7
Molecular Formula:
C16H18O2
Molecular Weight:
242.3129
IUPAC Name:
6-methoxy-2,2-dimethyl-3,4-dihydrobenzo[h]chromene
InChI:
InChI=1S/C16H18O2/c1-16(2)9-8-11-10-14(17-3)12-6-4-5-7-13(12)15(11)18-16/h4-7,10H,8-9H2,1-3H3
InChI Key:
OZVDAMFCGBFOHR-UHFFFAOYSA-N
SMILES:
COc1cc2CCC(Oc2c2c1cccc2)(C)C
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.131g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.318g/mol
Monoisotopic Mass:
242.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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