1-Cyclopropylpyrazole-4-boronic Acid - CAS 1678534-30-9

Catalog:	BB012426
Product Name:	1-Cyclopropylpyrazole-4-boronic Acid
CAS:	1678534-30-9
Synonyms:	(1-cyclopropyl-4-pyrazolyl)boronic acid; (1-cyclopropylpyrazol-4-yl)boronic acid

Technical Data

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Computed Properties

IUPAC Name:	(1-cyclopropylpyrazol-4-yl)boronic acid
Description:	1-Cyclopropylpyrazole-4-boronic Acid (CAS# 1678534-30-9) is a useful research chemical.
Molecular Weight:	151.96
Molecular Formula:	C6H9N2O2B
Canonical SMILES:	B(C1=CN(N=C1)C2CC2)(O)O
InChI:	InChI=1S/C6H9BN2O2/c10-7(11)5-3-8-9(4-5)6-1-2-6/h3-4,6,10-11H,1-2H2
InChI Key:	HACQYPYUKMKUPY-UHFFFAOYSA-N

Publication Number	Title	Priority Date
WO-2020108613-A1	Heteroaromatic derivatives for use as regulator, preparation method therefor and use thereof	20181130
CN-111511738-A	Heteroaromatic derivative regulator, preparation method and application thereof	20181130
TW-202033519-A	Heteroaromatic derivative regulator, its preparation method and application	20181130
KR-20210099611-A	Heteroaromatic derivative control agent, preparation method and use thereof	20181130
WO-2019223718-A1	Immunomodulator	20180522

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Complexity:	152
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	152.0757077
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	152.0757077
Rotatable Bond Count:	2
Topological Polar Surface Area:	58.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0