AG00372S

612511-81-6 | (1-Methyl-1H-pyrazol-3-yl)methanamine

AG00372S

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CAS Number	612511-81-6
Catalog Number	AG00372S(AGN-PC-0LW8LB)
Chemical Name	(1-Methyl-1H-pyrazol-3-yl)methanamine
IUPAC Name	(1-methylpyrazol-3-yl)methanamine
InChI	InChI=1S/C5H9N3/c1-8-3-2-5(4-6)7-8/h2-3H,4,6H2,1H3
InChI Key	SSXDUSOCSNXBPO-UHFFFAOYSA-N
MDL Number	MFCD03419807
Molecular Formula	C5H9N3
Molecular Weight	111.1451
SMILES	CN1N=C(C=C1)CN
Synonyms	612511-81-6, (1-methyl-1H-pyrazol-3-yl)methanamine, (1-methyl-1h-pyrazol-3-yl)methylamine, (1-methylpyrazol-3-yl)methanamine, C-(1-Methyl-1H-pyrazol-3-yl)-methylamine, 1H-PYRAZOLE-3-METHANAMINE, 1-METHYL-, 1H-Pyrazole-3-methanamine,1-methyl-, 3-(aminomethyl)-1-methyl-1h-pyrazole, 1-(1-methyl-1H-pyrazol-3-yl)methanamine, (1-methylpyrazol-3-yl)methylamine, MFCD03419807, SCHEMBL348762, CTK5B2935, DTXSID40427116, 3-(Aminomethyl)-1-methylpyrazole, SSXDUSOCSNXBPO-UHFFFAOYSA-N, ALBB-021649, KS-000029YL, ZINC2559427, ANW-54809, BBL104303, SBB020585, STK301288, 3-AMINOMETHYL-1-METHYLPYRAZOLE, AKOS000308246, MCULE-7962849515, PB29254, PS-3529, (1-Methyl-1H-pyrazole-3-yl)methylamine, AJ-40244, AK-82990, AN-16553, SC-48429, DB-072917, RT-021798, AM20100490, CS-0053896, FT-0720788, ST45091175, Y5488, Q-2004, [(1-METHYL-1H-PYRAZOL-3-YL)METHYL]AMINE, (1-Methyl-1H-pyrazol-3-yl)methylamine, AldrichCPR, J-500225, I14-10683, Z1552005001, C5H9N3, CID7019419,

Complexity	74.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	111.08g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	111.148g/mol
Monoisotopic Mass	111.08g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	43.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.9

GHS Hazard and Precautionary Statements

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

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