AG0022YT

Name: 1-Benzylpyrrole-2-carboxylic acid
Brand: Angene Chemical
SKU: AG0022YT

18159-22-3 | 1-Benzylpyrrole-2-carboxylic acid

AG0022YT

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COA

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CAS Number	18159-22-3
Catalog Number	AG0022YT(AGN-PC-0037BT)
Chemical Name	1-Benzylpyrrole-2-carboxylic acid
IUPAC Name	1-benzylpyrrole-2-carboxylic acid
InChI	InChI=1S/C12H11NO2/c14-12(15)11-7-4-8-13(11)9-10-5-2-1-3-6-10/h1-8H,9H2,(H,14,15)
InChI Key	OGGDCEFWAMGBOB-UHFFFAOYSA-N
MDL Number	MFCD00894448
Molecular Formula	C12H11NO2
Molecular Weight	201.2212
SMILES	O=C(C1=CC=CN1CC2=CC=CC=C2)O
Synonyms	1-benzyl-1H-pyrrole-2-carboxylic acid, 18159-22-3, 1-BENZYL-PYRROLE-2-CARBOXYLIC ACID, N-benzyl-2-pyrrolcarboxylic acid, 1-benzylpyrrole-2-carboxylic acid, AC1Q73PQ, SCHEMBL1607395, CHEMBL3786297, CTK4D7928, ZINC12452, DTXSID00566575, N-benzylpyrrole-2-carboxylic acid, OGGDCEFWAMGBOB-UHFFFAOYSA-N, 9690AH, AKOS009153614, MCULE-8474169077, NE50778, AJ-08350, DB-065370, FT-0690970, EN300-29736, 1H-Pyrrole-2-carboxylic acid, 1-(phenylmethyl)-, Z235352163, C12H11NO2,

Complexity	224
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	201.079g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	201.225g/mol
Monoisotopic Mass	201.079g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	42.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited