Benzohydrazide 4-boronic acid

CAT: 0024-sc-263015Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-263015Size:1 g

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CAS Number

850567-95-2

Chemical Information

(4-(Hydrazinecarbonyl)phenyl)boronic acid

CAS Number	850567-95-2
PubChem CID	44119530
IUPAC Name	[4-(hydrazinecarbonyl)phenyl]boronic acid
Molecular Formula	C7H9BN2O3
Molecular Weight	179.97
Topological Polar Surface Area	95.6
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Heavy Atom Count	13
Formal Charge	0
Complexity	181

SMILES

B(C1=CC=C(C=C1)C(=O)NN)(O)O

InChI

InChI=1S/C7H9BN2O3/c9-10-7(11)5-1-3-6(4-2-5)8(12)13/h1-4,12-13H,9H2,(H,10,11)

InChIKey

TZOYLNOZUCPDCL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 850567-95-2

CID: 44119530

Formula: C7H9BN2O3

MW: 179.97

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	179.97
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	180.0706223
Monoisotopic Mass	180.0706223
Topological Polar Surface Area	95.6 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	181
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-314914	4- (Cyclopentyloxy) benzohydrazide
sc-314846	4- (Allyloxy) benzohydrazide
sc-314964	4- (Isopentyloxy) benzohydrazide
sc-314865	4- (Benzylamino) benzohydrazide
sc-348363A	4- (methylsulfonyl) benzohydrazide
sc-314945	4- (Hexyloxy) benzohydrazide
sc-284063	4- (diethylamino) benzohydrazide
sc-348363	4- (methylsulfonyl) benzohydrazide
sc-278753	Benzoylchloride-4-boronic acid
sc-264062A	Phenoxathiin-4-boronic acid

Catalog	Name
AR-I01523-01	4-chloro-1- (4-Methoxyphenyl) benzohydrazide sulfonic acid sodium salt
SDC73462-01	4- (Sulfanylmethyl) benzohydrazide
DFA95865-01	4- (Benzyloxy) benzohydrazide
PC103911-01	4- (Difluoromethoxy) benzohydrazide
PCA32863-01	4- (Hexyloxy) benzohydrazide
WDB42656-01	4- (Isopentyloxy) benzohydrazide
CQA76937-01	4- (Phenoxymethyl) benzohydrazide
EXA40433-01	4- (4-Chlorophenoxymethyl) benzohydrazide
FQA17020	4- (4-Ethoxyphenoxymethyl) benzohydrazide
OR1062255-01	4,4',4''-Nitrilotri (benzohydrazide)