5-bromo-2-butoxybenzaldehyde

5-bromo-2-butoxybenzaldehyde

CAS: 515148-88-6

Formula: C11H13BrO2

SMILES: CCCCOC1=C(C=O)C=C(Br)C=C1

IUPAC: 5-bromo-2-butoxybenzaldehyde

InChI: InChI=1S/C11H13BrO2/c1-2-3-6-14-11-5-4-10(12)7-9(11)8-13/h4-5,7-8H,2-3,6H2,1H3

Composition: C (51.38%), H (5.10%), Br (31.08%), O (12.44%)

Molar Mass: 257.127

Atom Count: 27

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	256.009893
Formal Charge	0
FSP3	0.36
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	DRYBGKILXZPPQT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.6
Topological Polar Surface Area	26.3
Polarizability	23.05
Ring Count	1
Rotatable Bond Count	5

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