tert-butyl 2-formylbenzoate

tert-butyl 2-formylbenzoate

CAS: 907948-73-6

Formula: C12H14O3

SMILES: CC(C)(C)OC(=O)C1=C(C=O)C=CC=C1

IUPAC: 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

Composition: C (69.89%), H (6.84%), O (23.27%)

Molar Mass: 206.241

Atom Count: 29

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	206.094294311
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	AMGDHQPXAGWBSF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.47
Topological Polar Surface Area	43.37
Polarizability	22.17
Ring Count	1
Rotatable Bond Count	4

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