AG000VS0

1312368-90-3 | Boronic acid, B-1H-pyrrolo[2,3-c]pyridin-4-yl-

AG000VS0

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CAS Number	1312368-90-3
Catalog Number	AG000VS0(AGN-PC-0WBSYM)
Chemical Name	Boronic acid, B-1H-pyrrolo[2,3-c]pyridin-4-yl-
IUPAC Name	1H-pyrrolo[2,3-c]pyridin-4-ylboronic acid
InChI	InChI=1S/C7H7BN2O2/c11-8(12)6-3-9-4-7-5(6)1-2-10-7/h1-4,10-12H
InChI Key	SAVDQQWZBYXDJN-UHFFFAOYSA-N
MDL Number	MFCD22191961
Molecular Formula	C7H7BN2O2
Molecular Weight	161.9537
SMILES	OB(C1=CN=CC2=C1C=CN2)O
Synonyms	1312368-90-3, (1H-Pyrrolo[2,3-c]pyridin-4-yl)boronic acid, 6-Azaindole-4-boronic acid, {1H-pyrrolo[2,3-c]pyridin-4-yl}boronic acid, Boronic acid, B-1H-pyrrolo[2,3-c]pyridin-4-yl-, 1H-pyrrolo[2,3-c]pyridin-4-ylboronic acid, SCHEMBL16085257, DTXSID70726008, KS-000004JN, MFCD22191961, AKOS025290979, ZINC170016954, FCH2301567, SB11921, AK171022, AS-34029, OR360658, CS-0052963, FT-0769911, D-1672, boronic acid,b-1h-pyrrolo[2,3-c]pyridin-4-yl-, B-1H-pyrrolo[2,3-c]pyridin-4-ylBoronic acid,

Complexity	168
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	162.06g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	161.955g/mol
Monoisotopic Mass	162.06g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	69.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number