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methyl 2-[(4-chlorophenyl)(hydroxy)methyl]prop-2-enoate

methyl 2-[(4-chlorophenyl)(hydroxy)methyl]prop-2-enoate

CAS: 131469-67-5

Formula: C11H11ClO3

SMILES: COC(=O)C(=C)C(O)C1=CC=C(Cl)C=C1

IUPAC: methyl 2-[(4-chlorophenyl)(hydroxy)methyl]prop-2-enoate

InChI: InChI=1/C11H11ClO3/c1-7(11(14)15-2)10(13)8-3-5-9(12)6-4-8/h3-6,10,13H,1H2,2H3

Composition: C (58.29%), H (4.89%), Cl (15.64%), O (21.18%)

Molar Mass: 226.66

Atom Count: 26

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 226.0396719
Formal Charge 0
FSP3 0.18
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey GBKHNNKNMGBHSY-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 57.28
Topological Polar Surface Area 46.53
Polarizability 22.57
Ring Count 1
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
95% <6 Days 131469-67-5 $477.25-$3,795.00$477.25$509.45$2,317.25$3,795.00
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