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3411-03-8 | 3-Chloro-4-methylbenzaldehyde
CAS No: 3411-03-8 Catalog No: AG003J8K MDL No:MFCD06411284
Product Description
Catalog Number:
AG003J8K
Chemical Name:
3-Chloro-4-methylbenzaldehyde
CAS Number:
3411-03-8
Molecular Formula:
C8H7ClO
Molecular Weight:
154.5936
MDL Number:
MFCD06411284
IUPAC Name:
3-chloro-4-methylbenzaldehyde
InChI:
InChI=1S/C8H7ClO/c1-6-2-3-7(5-10)4-8(6)9/h2-5H,1H3
InChI Key:
OJFQNFVCICBYQC-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)Cl)C
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.019g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.593g/mol
Monoisotopic Mass:
154.019g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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