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88628-47-1 | 1(2H)-Naphthalenone, 6-[(4-chlorophenyl)methoxy]-3,4-dihydro-
CAS No: 88628-47-1 Catalog No: AG004BS0 MDL No:
Product Description
Catalog Number:
AG004BS0
Chemical Name:
1(2H)-Naphthalenone, 6-[(4-chlorophenyl)methoxy]-3,4-dihydro-
CAS Number:
88628-47-1
Molecular Formula:
C17H15ClO2
Molecular Weight:
286.7528
IUPAC Name:
6-[(4-chlorophenyl)methoxy]-3,4-dihydro-2H-naphthalen-1-one
InChI:
InChI=1S/C17H15ClO2/c18-14-6-4-12(5-7-14)11-20-15-8-9-16-13(10-15)2-1-3-17(16)19/h4-10H,1-3,11H2
InChI Key:
HEIYQEPVCOFWEN-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)COc1ccc2c(c1)CCCC2=O
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.076g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.755g/mol
Monoisotopic Mass:
286.076g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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