4-(Dihydroxyboryl)-2-nitrobenzoic acid - CAS 80500-28-3

Catalog:	BB055947
Product Name:	4-(Dihydroxyboryl)-2-nitrobenzoic acid
CAS:	80500-28-3
Synonyms:	4-borono-2-nitrobenzoic acid; 3-NITRO-4-CARBOXYPHENYLBORONIC ACID; 4-(DIHYDROXYBORYL)-2-NITROBENZOIC ACID; 4-(DIHYDROXYBORYL)-2-NITROBENZOICACID; 4-(DIHYDROXYBORANYL)-2-NITROBENZOIC ACID; 4-borono-2-nitro-benzoic acid; Benzoic acid, 4-borono-2-nitro-

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Computed Properties

IUPAC Name:	4-borono-2-nitrobenzoic acid
Description:	4-(Dihydroxyboryl)-2-nitrobenzoic acid
Molecular Weight:	210.94
Molecular Formula:	C7H6BNO6
Canonical SMILES:	B(C1=CC(=C(C=C1)C(=O)O)[N+](=O)[O-])(O)O
InChI:	InChI=1S/C7H6BNO6/c10-7(11)5-2-1-4(8(12)13)3-6(5)9(14)15/h1-3,12-13H,(H,10,11)
InChI Key:	APQGIZKNZHGXTG-UHFFFAOYSA-N

Publication Number	Title	Priority Date
AU-2016413933-A1	Bi-functional co-polymer use for ophthalmic and other topical and local applications	20160706
US-2019134079-A1	Bi-functional co-polymer use for ophthalmic and other topical and local applications	20160706
WO-2018009177-A1	Bi-functional co-polymer use for ophthalmic and other topical and local applications	20160706
US-11135242-B2	Bi-functional co-polymer use for ophthalmic and other topical and local applications	20160706
US-2022023334-A1	Bi-functional co-polymer use for ophthalmic and other topical and local applications	20160706
WO-2011127933-A1	Bi-functional complexes and methods for making and using such complexes	20100416
EP-2499167-A1	Compositions and methods for treating a disorder or defect in soft tissue	20091109
US-2013052155-A1	Compositions and Methods for Treating a Disorder or Defect in Soft Tissue	20091109
US-2019136018-A1	Compositions and Methods for Treating a Disorder or Defect in Soft Tissue	20091109
WO-2011057286-A1	Compositions and methods for treating a disorder or defect in soft tissue	20091109

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364
Signal Word:	Warning

Complexity:	265
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	211.0288171
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	211.0288171
Rotatable Bond Count:	2
Topological Polar Surface Area:	124Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0