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Home > Aldehydes > 181297-82-5
181297-82-5 | 2-[4-(TERT-BUTYL)PHENOXY]BENZENECARBALDEHYDE
CAS No: 181297-82-5 Catalog No: AG00AMRR MDL No:MFCD01568764
Product Description
Catalog Number:
AG00AMRR
Chemical Name:
2-[4-(TERT-BUTYL)PHENOXY]BENZENECARBALDEHYDE
CAS Number:
181297-82-5
Molecular Formula:
C17H18O2
Molecular Weight:
254.3236
MDL Number:
MFCD01568764
IUPAC Name:
2-(4-tert-butylphenoxy)benzaldehyde
InChI:
InChI=1S/C17H18O2/c1-17(2,3)14-8-10-15(11-9-14)19-16-7-5-4-6-13(16)12-18/h4-12H,1-3H3
InChI Key:
KGRDMITVHSQHJV-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1Oc1ccc(cc1)C(C)(C)C
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.131g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.329g/mol
Monoisotopic Mass:
254.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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