AG002RFP

26033-27-2 | 3-(Thiophen-2-Yl)-1H-Pyrazole-4-Carbaldehyde

AG002RFP

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CAS Number	26033-27-2
Catalog Number	AG002RFP(AGN-PC-0O8D24)
Chemical Name	3-(Thiophen-2-Yl)-1H-Pyrazole-4-Carbaldehyde
IUPAC Name	5-thiophen-2-yl-1H-pyrazole-4-carbaldehyde
InChI	InChI=1S/C8H6N2OS/c11-5-6-4-9-10-8(6)7-2-1-3-12-7/h1-5H,(H,9,10)
InChI Key	DDQIKYLVCQKLHT-UHFFFAOYSA-N
MDL Number	MFCD02677688
Molecular Formula	C8H6N2OS
Molecular Weight	178.2110
SMILES	O=CC1=CNN=C1C2=CC=CS2
Synonyms	26033-27-2, 3-(thiophen-2-yl)-1h-pyrazole-4-carbaldehyde, 3-(2-THIENYL)-1H-PYRAZOLE-4-CARBALDEHYDE, 3-thien-2-yl-1H-pyrazole-4-carbaldehyde, 3-Thiophen-2-yl-1H-pyrazole-4-carbaldehyde, 5-thiophen-2-yl-1H-pyrazole-4-carbaldehyde, 5-(thiophen-2-yl)-1H-pyrazole-4-carbaldehyde, 1H-Pyrazole-4-carboxaldehyde,3-(2-thienyl)-, 1H-Pyrazole-4-carboxaldehyde, 3-(2-thienyl)-, ZERO/005236, AC1LEJW4, AC1Q6QEX, AC1Q6PY8, AC1Q6PY9, SCHEMBL1337388, CTK4F6966, DTXSID80353208, DDQIKYLVCQKLHT-UHFFFAOYSA-N, ALBB-000094, KS-00000NA6, ZINC8701127, 2211AB, BBL013528, HTS001847, MFCD02677688, SBB073277, STK499929, 3-(2-thienyl)pyrazole-4-carbaldehyde, 5-(2-thienyl)pyrazole-4-carbaldehyde, AKOS000266169, AKOS005167455, BS-3964, CT-1003, DS-2850, MCULE-9086500426, NCGC00342520-01, AJ-58533, AK-45833, BAS 10141308, CJ-13512, SC-20973, AB0001942, DB-032377, ST2410396, ST4111314, TC-060144, 3-(2-thienyl)-1h-pyrazole-4-carboxaldehyde, 4CH-016224, BB 0221290, BB 0249072, FT-0613592, T7590, EN300-24712, 3-(Thien-2-yl)-1H-pyrazole-4-carboxaldehyde, 3-(thiophen-2-yl)-2H-pyrazole-4-carbaldehyde, Y-1633, AB01334533-02, I14-12962, 3-(2-Thienyl)-1H-pyrazole-4-carbaldehyde, AldrichCPR, C8H6N2OS, AR-1E6439, CID737231, ACN-039177, 3- -1H-PYRAZOLE-4-CARBALDEHYDE, 2621-68-3,

Complexity	176
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	178.02g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	178.209g/mol
Monoisotopic Mass	178.02g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	74A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

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

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