AG0030L7

3058-39-7 | Benzonitrile, 4-iodo-

AG0030L7

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CAS Number	3058-39-7
Catalog Number	AG0030L7(AGN-PC-09RD89)
Chemical Name	Benzonitrile, 4-iodo-
IUPAC Name	4-iodobenzonitrile
InChI	InChI=1S/C7H4IN/c8-7-3-1-6(5-9)2-4-7/h1-4H
InChI Key	XOKDXPVXJWTSRM-UHFFFAOYSA-N
MDL Number	MFCD00051310
Molecular Formula	C7H4IN
Molecular Weight	229.0178
NSC Number	87894
SMILES	IC1=CC=C(C#N)C=C1
Synonyms	4-Iodobenzonitrile, 3058-39-7, p-Iodobenzonitrile, Benzonitrile, 4-iodo-, p-Cyanoiodobenzene, 1-Cyano-4-iodobenzene, Benzonitrile, p-iodo-, 4-CYANOIODOBENZENE, 4-Iodo benzonitrile, 4-iodo-benzonitrile, MFCD00051310, XOKDXPVXJWTSRM-UHFFFAOYSA-N, AK-45950, 4-iodobenzenecarbonitrile, EN300-67216, 4-Iodobenzonitrile, 99%, 4-iodbenzonitril, p-iodo-benzonitrile, NSC 87894, PubChem3936, ACMC-1CQRA, AC1Q4RFW, 4-Iodobenzonitrile, 97%, AC1L2QZ8, AC1Q4P7D, SCHEMBL82069, KSC222M5T, Benzonitrile, p-iodo- (8CI), Jsp005766, DTXSID3062819, CTK1C2659, KS-00000EHE, TIMTEC-BB SBB017618, 3058-39-7 4-Iodobenzonitrile, ACT08158, NSC87894, ZINC2022082, ZX-AT006422, ANW-26922, BBL015060, CL8216, DT1507, NSC-87894, OR4305, SBB017618, STK078338, WT1371, AKOS005146080, AS03752, CM13127, CS-W009114, DS-1568, FCH1317810, MCULE-7080280156, PS-7742, RP17552, RTR-032804, TRA0067248, AC-22944, AJ-32774, BBV-40193637, BR-45950, CC-19609, CJ-07431, CJ-31537, Q178, SC-03294, SY016999, AX8008311, DB-014491, ST2411483, TR-032804, AM20040140, FT-0081771, FT-0634624, FT-0656489, I0661, ST50875038, MFCD00051310 (98%), M-5736, 058I397, C-13161, I01-0356, I01-5383, J-018030, J-515571, Z57899725, p-Jodbenzonitril, 4-Jodbenzonitril, C7H4IN, 1-Iodo-4-methylbenzene, 4-Iodobenzonitrile, 98% 5g, C7-H4-I-N, CID76467, AR-1G2901, 4-Iodobenzonitrile, 98% - 1G 1g, ACN-029177, A5604, 31780-26-4, 4931-66-2,

Complexity	127
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	228.939g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	229.02g/mol
Monoisotopic Mass	228.939g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	23.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H335
Precuationary statements	P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Siginal words	unknown

Certificate of Analysis

Lot Number