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Home > Aldehydes > 111923-01-4
111923-01-4 | 1,3-Naphthalenedicarboxaldehyde, 4-chloro-5,6,7,8-tetrahydro-
CAS No: 111923-01-4 Catalog No: AG00840I MDL No:
Product Description
Catalog Number:
AG00840I
Chemical Name:
1,3-Naphthalenedicarboxaldehyde, 4-chloro-5,6,7,8-tetrahydro-
CAS Number:
111923-01-4
Molecular Formula:
C12H11ClO2
Molecular Weight:
222.6675
IUPAC Name:
4-chloro-5,6,7,8-tetrahydronaphthalene-1,3-dicarbaldehyde
InChI:
InChI=1S/C12H11ClO2/c13-12-9(7-15)5-8(6-14)10-3-1-2-4-11(10)12/h5-7H,1-4H2
InChI Key:
BJFDRPPRJYTJJC-UHFFFAOYSA-N
SMILES:
O=Cc1cc(C=O)c(c2c1CCCC2)Cl
Properties
Complexity:
254
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:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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