4-Chloro-2-(methoxycarbonyl)phenylboronic Acid - CAS 1612256-37-7

Catalog:	BB011717
Product Name:	4-Chloro-2-(methoxycarbonyl)phenylboronic Acid
CAS:	1612256-37-7
Synonyms:	(4-chloro-2-methoxycarbonylphenyl)boronic acid; (4-chloro-2-methoxycarbonylphenyl)boronic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	(4-chloro-2-methoxycarbonylphenyl)boronic acid
Description:	4-Chloro-2-(methoxycarbonyl)phenylboronic Acid (CAS# 1612256-37-7) is a useful research chemical.
Molecular Weight:	214.41
Molecular Formula:	C8H8ClO4B
Canonical SMILES:	B(C1=C(C=C(C=C1)Cl)C(=O)OC)(O)O
InChI:	InChI=1S/C8H8BClO4/c1-14-8(11)6-4-5(10)2-3-7(6)9(12)13/h2-4,12-13H,1H3
InChI Key:	CVYLRXWWSGNWHX-UHFFFAOYSA-N
LogP:	-0.19360

Publication Number	Title	Priority Date
CN-113321659-A	Organic electroluminescent material and device thereof	20210527
CN-111606812-A	Triarylamine derivative and organic electroluminescent device thereof	20200525
CN-111606812-B	Triarylamine derivative and organic electroluminescent device thereof	20200525
WO-2021104749-A1	Compounds for electronic devices	20191126
WO-2020055672-A1	Fused heterocyclic compounds as ret kinase inhibitors	20180910

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Related Functional Groups

Boronic Acids and Esters

[2454490-85-6]
2-(7,8-Difluoro-1-naphthyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
[355836-10-1]
2-Methoxy-4-(trifluoromethoxy)phenylboronic Acid
[881302-73-4]
3,5-Dicarboxyphenylboronic Acid
[470478-90-1]
4-(4-Boc-piperazino)phenylboronic Acid Pinacol Ester
[937796-06-0]
4-(3,5-Dimethyl-1-pyrazolyl)phenylboronic Acid Pinacol Ester
[1256358-61-8]
3-[(2-Methoxyethoxy)methyl]phenylboronic Acid

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	212
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	214.0204166
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	214.0204166
Rotatable Bond Count:	3
Topological Polar Surface Area:	66.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0