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907948-73-6 | tert-Butyl 2-formylbenzoate
CAS No: 907948-73-6 Catalog No: AG01FFFJ MDL No:MFCD02180884
Product Description
Catalog Number:
AG01FFFJ
Chemical Name:
tert-Butyl 2-formylbenzoate
CAS Number:
907948-73-6
Molecular Formula:
C12H14O3
Molecular Weight:
206.2378
MDL Number:
MFCD02180884
IUPAC Name:
tert-butyl 2-formylbenzoate
InChI:
InChI=1S/C12H14O3/c1-12(2,3)15-11(14)10-7-5-4-6-9(10)8-13/h4-8H,1-3H3
InChI Key:
AMGDHQPXAGWBSF-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1C(=O)OC(C)(C)C
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.094g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.241g/mol
Monoisotopic Mass:
206.094g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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