AG00GA14

81542-51-0 | 4-iodo-1H-pyrazol-5-amine

AG00GA14

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CAS Number	81542-51-0
Catalog Number	AG00GA14(AGN-PC-0WNLSX)
Chemical Name	4-iodo-1H-pyrazol-5-amine
IUPAC Name	4-iodo-1H-pyrazol-5-amine
InChI	InChI=1S/C3H4IN3/c4-2-1-6-7-3(2)5/h1H,(H3,5,6,7)
InChI Key	CPVCVVMJPIOKMN-UHFFFAOYSA-N
MDL Number	MFCD12022325
Molecular Formula	C3H4IN3
Molecular Weight	208.9884
SMILES	NC1=NNC=C1I
Synonyms	4-Iodo-1H-pyrazol-3-amine, 81542-51-0, 3-Amino-4-iodo-1H-pyrazole, 4-iodo-1H-pyrazol-5-amine, 4-Iodo-3-aminopyrazole, 3-AMino-4-iodo-1H-pyrazole, 97%, 3-amino-4-iodo-pyrazole, SCHEMBL1248250, 1H-pyrazol-5-amine, 4-iodo-, SCHEMBL19120114, CTK7C3107, DTXSID00510997, CPVCVVMJPIOKMN-UHFFFAOYSA-N, ALBB-022287, KS-00001A5N, MFCD12022325, STL415306, ZINC36533659, 3-Amino-4-iodo-1H-pyrazole, 95%, AKOS015960270, AKOS015997921, MCULE-4763278542, AJ-93232, AM804371, DA-03140, FT-0721349, T5455, Z2106610702,

Complexity	67.2
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	208.945g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	208.99g/mol
Monoisotopic Mass	208.945g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	54.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

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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