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Structure

2-(2'-Chlorobenzyloxy)phenylboronic acid

CAS
870777-21-2
Catalog Number
ACM870777212
Category
Other Products
Molecular Weight
262.5g/mol
Molecular Formula
C13H12BClO3

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Specification

Synonyms
2-(2-Chlorobenzyloxy)phenylboronic acid, 870777-21-2, 2-(2-Chlorobenzyloxy)phenylboronic acid, SureCN2554369, 639443_ALDRICH, CTK8B2498, MolPort-002-052-408, ANW-38459, AKOS009319100, AB23047, AK-45391, KB-13986, (2-((2-Chlorobenzyl)oxy)phenyl)boronic acid, I01-16381, (2-[(2-CHLOROPHENYL)METHOXY]PHENYL)BORONIC ACID, 2-(2 inverted exclamation marka-Chlorobenzyloxy)phenylboronic acid
IUPAC Name
[2-[(2-chlorophenyl)methoxy]phenyl]boronic acid
Canonical SMILES
B(C1=CC=CC=C1OCC2=CC=CC=C2Cl)(O)O
InChI
InChI=1S/C13H12BClO3/c15-12-7-3-1-5-10(12)9-18-13-8-4-2-6-11(13)14(16)17/h1-8,16-17H,9H2
InChI Key
OOORTTOHYXWCDV-UHFFFAOYSA-N
Boiling Point
454.8ºC at 760 mmHg
Melting Point
124-129ºC(lit.)
Flash Point
228.9ºC
Density
1.3g/cm³
Complexity
252
Covalently-Bonded Unit Count
1
Exact Mass
262.056802g/mol
Formal Charge
0
H-Bond Acceptor
3
H-Bond Donor
2
Heavy Atom Count
18
Monoisotopic Mass
262.056802g/mol
Rotatable Bond Count
4
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