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2-[(3-chlorophenyl)methyl]-5-methyl-1,3-benzoxazole

2-[(3-chlorophenyl)methyl]-5-methyl-1,3-benzoxazole

Formula: C15H12ClNO

SMILES: CC1=CC=C2OC(CC3=CC(Cl)=CC=C3)=NC2=C1

IUPAC: 2-[(3-chlorophenyl)methyl]-5-methyl-1,3-benzoxazole

InChI: InChI=1S/C15H12ClNO/c1-10-5-6-14-13(7-10)17-15(18-14)9-11-3-2-4-12(16)8-11/h2-8H,9H2,1H3

Composition: C (69.91%), H (4.69%), Cl (13.76%), N (5.44%), O (6.21%)

Molar Mass: 257.72

Atom Count: 30

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 257.0607417
Formal Charge 0
FSP3 0.13
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey DATIAWIMXMPGGA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 71.73
Topological Polar Surface Area 26.03
Polarizability 28.81
Ring Count 3
Rotatable Bond Count 2

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Struchem co.,ltd
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Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C15H12ClNO $560.00-$2,420.00$560.00$1,541.00$2,420.00
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