2,3-dibromo-5-ethoxy-4-(prop-2-en-1-yloxy)benzaldehyde

2,3-dibromo-5-ethoxy-4-(prop-2-en-1-yloxy)benzaldehyde

CAS: 832673-80-0

Formula: C12H12Br2O3

SMILES: CCOC1=C(OCC=C)C(Br)=C(Br)C(C=O)=C1

IUPAC: 2,3-dibromo-5-ethoxy-4-(prop-2-en-1-yloxy)benzaldehyde

InChI: InChI=1S/C12H12Br2O3/c1-3-5-17-12-9(16-4-2)6-8(7-15)10(13)11(12)14/h3,6-7H,1,4-5H2,2H3

Composition: C (39.59%), H (3.32%), Br (43.90%), O (13.18%)

Molar Mass: 364.033

Atom Count: 29

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	361.91532
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	IOHUPFCAYMTGNF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	74.73
Topological Polar Surface Area	35.53
Polarizability	28.39
Ring Count	1
Rotatable Bond Count	6

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