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88728-56-7 | 1-(7-methoxy-2,2-dimethyl-chromen-6-yl)ethanol
CAS No: 88728-56-7 Catalog No: AG00468Z MDL No:
Product Description
Catalog Number:
AG00468Z
Chemical Name:
1-(7-methoxy-2,2-dimethyl-chromen-6-yl)ethanol
CAS Number:
88728-56-7
Molecular Formula:
C14H18O3
Molecular Weight:
234.2909
IUPAC Name:
1-(7-methoxy-2,2-dimethylchromen-6-yl)ethanol
InChI:
InChI=1S/C14H18O3/c1-9(15)11-7-10-5-6-14(2,3)17-12(10)8-13(11)16-4/h5-9,15H,1-4H3
InChI Key:
ZMQPULSGBXIVGC-UHFFFAOYSA-N
SMILES:
COc1cc2OC(C)(C)C=Cc2cc1C(O)C
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.126g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.295g/mol
Monoisotopic Mass:
234.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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