AG008GTT

850567-24-7 | (3-(Cyclopentylcarbamoyl)phenyl)boronic acid

AG008GTT

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CAS Number	850567-24-7
Catalog Number	AG008GTT(AGN-PC-0KZWAV)
Chemical Name	(3-(Cyclopentylcarbamoyl)phenyl)boronic acid
IUPAC Name	[3-(cyclopentylcarbamoyl)phenyl]boronic acid
InChI	InChI=1S/C12H16BNO3/c15-12(14-11-6-1-2-7-11)9-4-3-5-10(8-9)13(16)17/h3-5,8,11,16-17H,1-2,6-7H2,(H,14,15)
InChI Key	KIOBFDGZJVJNBP-UHFFFAOYSA-N
MDL Number	MFCD04115695
Molecular Formula	C12H16BNO3
Molecular Weight	233.0713
SMILES	OB(O)C1=CC(=CC=C1)C(=O)NC1CCCC1
Synonyms	850567-24-7, 3-(Cyclopentylaminocarbonyl)phenylboronic acid, (3-(Cyclopentylcarbamoyl)phenyl)boronic acid, 3-(Cyclopentylcarbamoyl)phenylboronic acid, [3-(cyclopentylcarbamoyl)phenyl]boronic Acid, 3-(Cyclopentylaminocarbonyl)benzeneboronic acid, MFCD04115695, N-CYCLOPENTYL-3-BORONOBENZAMIDE, PubChem16391, AC1MWKR2, ACMC-209q0d, SCHEMBL3040194, CTK5F3913, DTXSID50396268, ANW-37979, AKOS015840759, ZINC169745134, AB20422, AM87240, BP12109, RTR-026421, AN-27016, AS-55295, BP-12109, DB-076231, TR-026421, FT-0748749, X2359, B-5535, 3-(cyclopentylcarbamoyl)benzeneboronic acid, 98%, 567C247, A841085, [3-[(cyclopentylamino)-oxomethyl]phenyl]boronic acid, Boronic acid,B-[3-[(cyclopentylamino)carbonyl]phenyl]-, 3-(cyclopentylaminocarbonyl)phenylboronic acid, AldrichCPR, 3-[(cyclopentylamino)carbonyl]benzeneboronic acid, [(3-boronobenzoyl)amino]cyclopentane, C12H16BNO3, ACN-042675, CID3775808, 3-(CYCLOPENTYLCARBAMOYL)BENZENEBORONIC ACID, 3-(CYCLOPENTYLAMINOCARBONYL)PHENYLBORONICACID,

Complexity	267
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-P264-P270-P271-P280-P302+P352-P304+P340-P310-P330-P361-P403+P233-P405-P501
UN Code

Certificate of Analysis

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