AG003JY2

99662-34-7 | 4-Pyrazol-1-yl-benzaldehyde

AG003JY2

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CAS Number	99662-34-7
Catalog Number	AG003JY2(AGN-PC-0KKXK6)
Chemical Name	4-Pyrazol-1-yl-benzaldehyde
IUPAC Name	4-pyrazol-1-ylbenzaldehyde
InChI	InChI=1S/C10H8N2O/c13-8-9-2-4-10(5-3-9)12-7-1-6-11-12/h1-8H
InChI Key	PPGRDLZPSDHBIC-UHFFFAOYSA-N
MDL Number	MFCD02681938
Molecular Formula	C10H8N2O
Molecular Weight	172.1833
SMILES	C1=CC=N[N]1C2=CC=C(C=O)C=C2
Synonyms	4-(1H-pyrazol-1-yl)benzaldehyde, 99662-34-7, 4-Pyrazol-1-yl-benzaldehyde, 1-(4'-formylphenyl) pyrazole, 1-(4-Formylphenyl)-1H-pyrazole, 4-pyrazol-1-ylbenzaldehyde, 1-(4-formylphenyl)pyrazole, 4-(1-pyrazolyl)benzaldehyde, 4-(1H-Pyrazol-1-yl)benzenecarbaldehyde, Benzaldehyde, 4-(1H-pyrazol-1-yl)-, 4-pyrazolylbenzaldehyde, PubChem22713, AC1Q6PTH, timtec-bb sbb010131, chembrdg-bb 4004820, AC1MCR01, SCHEMBL98459, 4-Pvrazol-1-yl-benzaldehyde, MLS000718861, 4-(pyrazol-1-yl)benzaldehyde, asinex-reag bas 08767263, CHEMBL1370994, CTK3I8246, KS-00000AYC, DTXSID60380113, PPGRDLZPSDHBIC-UHFFFAOYSA-N, HMS2740B15, ZINC158880, 4-(1H-pyrazol-1-yl)-benzaldehyde, ANW-51042, BBL029748, CF-883, MFCD02681938, SBB010131, STL373192, AKOS000117918, AC-2656, CS-W022234, MCULE-2522873350, RP02723, TRA0020443, VZ27645, AJ-15384, AK-16213, AN-13747, BAS 08767263, BC227856, BP-10715, BR-16213, CJ-01840, EN002312, SC-27223, SMR000291129, SY002419, 4-(1h-pyrazol-1-yl)benzaldehyde, 95+%, AB0027962, DB-001627, TR-030469, AM20050519, BB 0220087, FT-0616475, ST24029210, ST50285689, W9882, EN300-27362, 4-(1H-Pyrazol-1-yl)benzaldehyde, AldrichCPR, A24840, C-6009, MFCD02681938 (97+%), 3T-0309, 662P347, J-513220, I14-10883, C10H8N2O, 4-(1H-Pyrazol-1-yl)benzoic acid, ZINC00158880, ACN-025425, CID2776477, 1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)methanamine,

Complexity	176
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.064g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	172.187g/mol
Monoisotopic Mass	172.064g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	34.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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