AG0032RX

31108-57-3 | 1H-Pyrazole-4-carbonitrile

AG0032RX

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CAS Number	31108-57-3
Catalog Number	AG0032RX(AGN-PC-0JSYTG)
Chemical Name	1H-Pyrazole-4-carbonitrile
IUPAC Name	1H-pyrazole-4-carbonitrile
InChI	InChI=1S/C4H3N3/c5-1-4-2-6-7-3-4/h2-3H,(H,6,7)
InChI Key	NUGZBVBZIDWZAD-UHFFFAOYSA-N
MDL Number	MFCD00040250
Molecular Formula	C4H3N3
Molecular Weight	93.0867
SMILES	N#Cc1c[nH]nc1
Synonyms	1H-Pyrazole-4-carbonitrile, 4-Cyanopyrazole, 31108-57-3, Pyrazole-4-carbonitrile, 4-Cyano-1H-pyrazole, NUGZBVBZIDWZAD-UHFFFAOYSA-N, AC1LBUFK, ACMC-1CP8V, AC1Q4RJ7, CTK1C2127, DTXSID90340402, ACN-P000943, ACT08126, KS-000006LV, ZINC2389916, ANW-27033, MFCD00040250, SBB055839, STL414870, AKOS005169241, CS-W007650, MCULE-4275978799, PB33792, RP18566, SB19925, TRA0049361, 1H-Pyrazole-4-carbonitrile, AldrichCPR, AJ-35631, AK-23770, BR-23770, CJ-08356, QC-11618, SC-74407, SY035874, AB0024121, ST2408928, TR-013262, 4CH-015920, FT-0619444, ST45255999, W5322, MFCD00040250 (95%), S-4878, 108C573, A820724, I14-0416, J-504725, F8883-2654, Z1741973419, C4H3N3, AR-1C3851, CID564449, ACN-025069, AE-562/43286933, 57090-88-7, 31301-62-9,

Complexity	101
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	93.033g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	93.089g/mol
Monoisotopic Mass	93.033g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	52.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.2

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