Text Search
Structure Search

4-(hydroxymethyl)-2-methylphenylboronic acid

4-(hydroxymethyl)-2-methylphenylboronic acid

CAS: 166386-66-9

Formula: C8H11BO3

SMILES: CC1=CC(CO)=CC=C1B(O)O

IUPAC: [4-(hydroxymethyl)-2-methylphenyl]boronic acid

InChI: InChI=1S/C8H11BO3/c1-6-4-7(5-10)2-3-8(6)9(11)12/h2-4,10-12H,5H2,1H3

Composition: C (57.89%), H (6.68%), B (6.51%), O (28.92%)

Molar Mass: 165.98

Atom Count: 23

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 166.080124
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 3
InChIKey IYJFMZDMFLQDCO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 42.46
Topological Polar Surface Area 60.69
Polarizability 17.75
Ring Count 1
Rotatable Bond Count 2

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
98% <7 Days 166386-66-9 $25.88-$928.40$25.88$43.47$121.10$522.68$928.40
Request Quote
AA BLOCKS INC
Supplier Profile
Purity LeadTime CAS PacketSize UnitPrice
98% <6 Days 166386-66-9 $31.05-$132.25$31.05$52.90$132.25
Request Quote
Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
98% <5 Days 166386-66-9 $40.35-$171.50$40.35$68.09$171.50
Request Quote