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66422-84-2 | Benzaldehyde, 3-chloro-4-(phenylmethoxy)-
CAS No: 66422-84-2 Catalog No: AG006LZB MDL No:MFCD00831645
Product Description
Catalog Number:
AG006LZB
Chemical Name:
Benzaldehyde, 3-chloro-4-(phenylmethoxy)-
CAS Number:
66422-84-2
Molecular Formula:
C14H11ClO2
Molecular Weight:
246.6889
MDL Number:
MFCD00831645
IUPAC Name:
3-chloro-4-phenylmethoxybenzaldehyde
InChI:
InChI=1S/C14H11ClO2/c15-13-8-12(9-16)6-7-14(13)17-10-11-4-2-1-3-5-11/h1-9H,10H2
InChI Key:
XFPGRCKILOWFOL-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)Cl)OCc1ccccc1
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.045g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.69g/mol
Monoisotopic Mass:
246.045g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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