3-(2-tert-butyl-5-methylphenoxymethyl)-4-methoxybenzaldehyde

3-(2-tert-butyl-5-methylphenoxymethyl)-4-methoxybenzaldehyde

CAS: 832737-62-9

Formula: C20H24O3

SMILES: COC1=CC=C(C=O)C=C1COC1=CC(C)=CC=C1C(C)(C)C

IUPAC: 3-[(2-tert-butyl-5-methylphenoxy)methyl]-4-methoxybenzaldehyde

InChI: InChI=1S/C20H24O3/c1-14-6-8-17(20(2,3)4)19(10-14)23-13-16-11-15(12-21)7-9-18(16)22-5/h6-12H,13H2,1-5H3

Composition: C (76.89%), H (7.74%), O (15.36%)

Molar Mass: 312.409

Atom Count: 47

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	312.172544633
Formal Charge	0
FSP3	0.35
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	YZFSXKZFGBCXBL-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	93.89
Topological Polar Surface Area	35.53
Polarizability	35.91
Ring Count	2
Rotatable Bond Count	6

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