AG0022AF

180741-37-1 | 1H-Pyrazole-1-propanol

AG0022AF

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CAS Number	180741-37-1
Catalog Number	AG0022AF(AGN-PC-01KXXF)
Chemical Name	1H-Pyrazole-1-propanol
IUPAC Name	3-pyrazol-1-ylpropan-1-ol
InChI	InChI=1S/C6H10N2O/c9-6-2-5-8-4-1-3-7-8/h1,3-4,9H,2,5-6H2
InChI Key	PMKIEDXXIYUBKC-UHFFFAOYSA-N
MDL Number	MFCD03727229
Molecular Formula	C6H10N2O
Molecular Weight	126.1564
SMILES	OCCCN1N=CC=C1
Synonyms	180741-37-1, 3-(1H-pyrazol-1-yl)propan-1-ol, 3-(1-Pyrazolyl)-1-propanol, 1H-Pyrazole-1-propanol, 3-(PYRAZOL-1-YL)-1-PROPANOL, 3-pyrazolylpropan-1-ol, 1-(3-hydroxypropyl)pyrazole, AC1Q7CSP, 3-pyrazol-1-ylpropan-1-ol, SCHEMBL2620759, 3-(pyrazol-1-yl)propan-1-ol, CTK0H1205, DTXSID60589841, PMKIEDXXIYUBKC-UHFFFAOYSA-N, 1-(3-Hydroxypropyl)-1H-pyrazole, ALBB-017775, ZINC9280638, 3-(1H-Pyrazol-1-yl)-1-propanol, 6058AD, BBL001816, MFCD03727229, SBB022862, STK346880, 3-(1H-Pyrazol-1-yl);propan-1-ol, AKOS000312008, MCULE-3560458600, TRA0037344, AJ-59490, AS-31757, SC-25083, SY003679, AB0072078, AB1001697, DB-065330, TC-307161, FT-0764548, ST45115404, EN300-72638, 3-(1H-Pyrazol-1-yl)-1-propanol, AldrichCPR, Y-0801, MFCD03727229 (97+%), I14-17426, Z1259086959, null, C6H10N2O, 917925-71-4, 1003-29-8,

Complexity	77.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	126.079g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	126.159g/mol
Monoisotopic Mass	126.079g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	38A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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