methyl 2-[4-(benzyloxy)-3-bromo-5-formylphenyl]acetate

methyl 2-[4-(benzyloxy)-3-bromo-5-formylphenyl]acetate

CAS: 583031-89-4

Formula: C17H15BrO4

SMILES: COC(=O)CC1=CC(Br)=C(OCC2=CC=CC=C2)C(C=O)=C1

IUPAC: methyl 2-[4-(benzyloxy)-3-bromo-5-formylphenyl]acetate

InChI: InChI=1S/C17H15BrO4/c1-21-16(20)9-13-7-14(10-19)17(15(18)8-13)22-11-12-5-3-2-4-6-12/h2-8,10H,9,11H2,1H3

Composition: C (56.22%), H (4.16%), Br (22.00%), O (17.62%)

Molar Mass: 363.207

Atom Count: 37

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	362.015372
Formal Charge	0
FSP3	0.18
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	GLHGIYOYXSQHIH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	87.42
Topological Polar Surface Area	52.6
Polarizability	33.42
Ring Count	2
Rotatable Bond Count	7

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	583031-89-4		$315.25-$1,624.17$315.25$974.75$1,624.17