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5-bromo-4-methoxy-2-methylbenzaldehyde

5-bromo-4-methoxy-2-methylbenzaldehyde

CAS: 1208795-91-8

Formula: C9H9BrO2

SMILES: COC1=C(Br)C=C(C=O)C(C)=C1

IUPAC: 5-bromo-4-methoxy-2-methylbenzaldehyde

InChI: InChI=1S/C9H9BrO2/c1-6-3-9(12-2)8(10)4-7(6)5-11/h3-5H,1-2H3

Composition: C (47.19%), H (3.96%), Br (34.88%), O (13.97%)

Molar Mass: 229.073

Atom Count: 21

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 227.978593
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey CVWXXVBSCRRCFA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 51.77
Topological Polar Surface Area 26.3
Polarizability 19.36
Ring Count 1
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 1208795-91-8 $262.20-$1,250.91$262.20$262.20$381.28$381.28$1,250.91$1,250.91
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