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chloromethyl benzoate

chloromethyl benzoate

CAS: 1254736

Formula: C8H7ClO2

SMILES: ClCOC(=O)C1=CC=CC=C1

IUPAC: chloromethyl benzoate

InChI: InChI=1S/C8H7ClO2/c9-6-11-8(10)7-4-2-1-3-5-7/h1-5H,6H2

Composition: C (56.33%), H (4.14%), Cl (20.78%), O (18.76%)

Molar Mass: 170.59

Atom Count: 18

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 170.0134572
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey BOXZXICVMMSYPE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 42.72
Topological Polar Surface Area 26.3
Polarizability 16.6
Ring Count 1
Rotatable Bond Count 3

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Kinentia Biosciences LLC
Purity LeadTime CAS PacketSize UnitPrice
96% <14 Days 1254736 $94.50-$141.75$94.50$141.75
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Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
98% <5 Days 1254736 $17.65-$122.32$17.65$73.14$122.32
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J&W PHARMLAB LLC
Purity LeadTime CAS PacketSize UnitPrice
96% <2 Days 1254736 $28.75-$782.00$28.75$86.25$276.00$782.00
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