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77664-95-0 | 1-Chloro-7-methoxy-3,4-dihydronaphthalene-2-carbaldehyde
CAS No: 77664-95-0 Catalog No: AG005SIJ MDL No:MFCD07371509
Product Description
Catalog Number:
AG005SIJ
Chemical Name:
1-Chloro-7-methoxy-3,4-dihydronaphthalene-2-carbaldehyde
CAS Number:
77664-95-0
Molecular Formula:
C12H11ClO2
Molecular Weight:
222.6675
MDL Number:
MFCD07371509
IUPAC Name:
1-chloro-7-methoxy-3,4-dihydronaphthalene-2-carbaldehyde
InChI:
InChI=1S/C12H11ClO2/c1-15-10-5-4-8-2-3-9(7-14)12(13)11(8)6-10/h4-7H,2-3H2,1H3
InChI Key:
SAGGDHBJEMMRSX-UHFFFAOYSA-N
SMILES:
COc1cc2C(=C(CCc2cc1)C=O)Cl
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.045g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.668g/mol
Monoisotopic Mass:
222.045g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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