AG003MSZ

77770-09-3 | 2-Amino-4-iodoanisole

AG003MSZ

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CAS Number	77770-09-3
Catalog Number	AG003MSZ(AGN-PC-00K0UK)
Chemical Name	2-Amino-4-iodoanisole
IUPAC Name	5-iodo-2-methoxyaniline
InChI	InChI=1S/C7H8INO/c1-10-7-3-2-5(8)4-6(7)9/h2-4H,9H2,1H3
InChI Key	KCAGMESWEMVFON-UHFFFAOYSA-N
MDL Number	MFCD03095407
Molecular Formula	C7H8INO
Molecular Weight	249.0490
SMILES	COC1=C(N)C=C(I)C=C1
Synonyms	2-Amino-4-iodoanisole, 5-iodo-2-methoxyaniline, 77770-09-3, 5-Iodo-o-anisidine, 2-METHOXY-5-IODOANILINE, Benzenamine, 5-iodo-2-methoxy-, MFCD03095407, 4-Methoxy-3-Amino-1-Iodobenzene, AC1Q4CXA, 5-iodo-2-methoxybenzenamine, 5-iodo-2-methoxy-phenylamine, SCHEMBL111536, CTK8F6878, DTXSID30512626, KCAGMESWEMVFON-UHFFFAOYSA-N, KS-00000F9D, ZINC2384168, AKOS005201873, AS05428, CM11585, CS-W014107, AJ-35082, AK-36369, DS-12918, SC-90037, DB-056255, ST2404126, 4CH-018800, FT-0641656, X5382, 2-Amino-4-iodoanisole[5-Iodo-2-methoxyaniline], C7H8INO,

Complexity	110
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	248.965g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	249.051g/mol
Monoisotopic Mass	248.965g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	35.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

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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