AG004PC4

850568-15-9 | (4-(Cyclopentylcarbamoyl)phenyl)boronic acid

AG004PC4

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CAS Number	850568-15-9
Catalog Number	AG004PC4(AGN-PC-0KKVDN)
Chemical Name	(4-(Cyclopentylcarbamoyl)phenyl)boronic acid
IUPAC Name	[4-(cyclopentylcarbamoyl)phenyl]boronic acid
InChI	InChI=1S/C12H16BNO3/c15-12(14-11-3-1-2-4-11)9-5-7-10(8-6-9)13(16)17/h5-8,11,16-17H,1-4H2,(H,14,15)
InChI Key	VMJFATWKBZYOFO-UHFFFAOYSA-N
MDL Number	MFCD03788418
Molecular Formula	C12H16BNO3
Molecular Weight	233.0713
SMILES	C(=O)(NC1CCCC1)c1ccc(cc1)B(O)O
Synonyms	850568-15-9, (4-(Cyclopentylcarbamoyl)phenyl)boronic acid, 4-(Cyclopentylaminocarbonyl)phenylboronic acid, 4-(cyclopentylcarbamoyl)phenylboronic acid, 4-Cyclopentylaminocarbonylphenylboronic acid, [4-(cyclopentylcarbamoyl)phenyl]boronic Acid, N-CYCLOPENTYL 4-BORONOBENZAMIDE, AC1MCMU0, ACMC-209q1f, AMTB363, SCHEMBL384423, CTK5F3946, DTXSID70378405, VMJFATWKBZYOFO-UHFFFAOYSA-N, ANW-38017, MFCD03788418, AKOS015949596, ZINC169745350, AB15993, AM87246, C2412G1, RP07540, RTC-068631, NCGC00249495-01, AS-55273, DA-02777, TC-068631, CS-0060789, FT-0685332, 4 - Cyclopentylaminocarbonylphenylboronic acid, 4-(Cyclopentylaminocarbonyl)benzeneboronic acid, B-5241, [4-(Cyclopentylaminocarbonyl)phenyl]boronic acid, 4-[(cyclopentylamino)carbonyl]phenylboronic acid, [4-(N-cyclopentylaminocarbonyl)phenyl]boronic acid, {4-[(cyclopentylamino)carbonyl]phenyl}boronic acid, 4-(cyclopentylcarbamoyl)benzeneboronic acid, 97%, [4-[(Cyclopentylamino)carbonyl]-phenyl]boronic acid, J-515241, Boronic acid, [4-[(cyclopentylamino)carbonyl]phenyl]-, 4-cyclopentylaminocarbonylphenylboronic acid, AldrichCPR, Boronic acid,B-[4-[(cyclopentylamino)carbonyl]phenyl]-, 4-[(cyclopentylamino)carbonyl]benzeneboronic acid, 4-borono-n-cyclopentylbenzamide, C12H16BNO3, ACN-042676, CID2773358, (4-(Cyclopentylcarbamoyl)phenyl)boronicacid, 4-(Cyclopentylaminocarbonyl)phenylboronicacid, 4-(CYCLOPENTYLCARBAMOYL)BENZENEBORONIC ACID,

Complexity	259
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	233.122g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	233.074g/mol
Monoisotopic Mass	233.122g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	69.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P280a-P304+P340-P305+P351+P338-P405-P501a
UN Code

Certificate of Analysis

Lot Number