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Home > Aldehydes > 861843-98-3
861843-98-3 | 2-Naphthalenecarboxaldehyde, 1-chloro-3,4-dihydro-3-methyl-
CAS No: 861843-98-3 Catalog No: AG004SW7 MDL No:
Product Description
Catalog Number:
AG004SW7
Chemical Name:
2-Naphthalenecarboxaldehyde, 1-chloro-3,4-dihydro-3-methyl-
CAS Number:
861843-98-3
Molecular Formula:
C12H11ClO
Molecular Weight:
206.6681
IUPAC Name:
1-chloro-3-methyl-3,4-dihydronaphthalene-2-carbaldehyde
InChI:
InChI=1S/C12H11ClO/c1-8-6-9-4-2-3-5-10(9)12(13)11(8)7-14/h2-5,7-8H,6H2,1H3
InChI Key:
ULXZSCJAUSVXBZ-UHFFFAOYSA-N
SMILES:
O=CC1=C(Cl)c2c(CC1C)cccc2
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.05g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.669g/mol
Monoisotopic Mass:
206.05g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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