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Home > Aldehydes > 1289158-75-3
1289158-75-3 | 4-chloro-3-propan-2-ylbenzaldehyde
CAS No: 1289158-75-3 Catalog No: AG01DFD6 MDL No:MFCD19686193
Product Description
Catalog Number:
AG01DFD6
Chemical Name:
4-chloro-3-propan-2-ylbenzaldehyde
CAS Number:
1289158-75-3
Molecular Formula:
C10H11ClO
Molecular Weight:
182.6467
MDL Number:
MFCD19686193
IUPAC Name:
4-chloro-3-propan-2-ylbenzaldehyde
InChI:
InChI=1S/C10H11ClO/c1-7(2)9-5-8(6-12)3-4-10(9)11/h3-7H,1-2H3
InChI Key:
SMDNJVODZCCOMT-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)C(C)C)Cl
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.05g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.647g/mol
Monoisotopic Mass:
182.05g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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