methyl 3-hydroxy-4-[2-(trimethylsilyl)ethynyl]benzoate

methyl 3-hydroxy-4-[2-(trimethylsilyl)ethynyl]benzoate

CAS: 478169-68-5

Formula: C13H16O3Si

SMILES: COC(=O)C1=CC=C(C#C[Si](C)(C)C)C(O)=C1

IUPAC: methyl 3-hydroxy-4-[2-(trimethylsilyl)ethynyl]benzoate

InChI: InChI=1S/C13H16O3Si/c1-16-13(15)11-6-5-10(12(14)9-11)7-8-17(2,3)4/h5-6,9,14H,1-4H3

Composition: C (62.87%), H (6.49%), O (19.33%), Si (11.31%)

Molar Mass: 248.353

Atom Count: 33

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	248.08687091
Formal Charge	0
FSP3	0.31
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	IGKWQEJDFVUAME-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.3
Topological Polar Surface Area	46.53
Polarizability	26.39
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<5 Days	478169-68-5		$41.61-$170.24$41.61$68.09$170.24