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AG003EKI

Name: 1-Nitropyrene
Brand: Angene Chemical
SKU: AG003EKI

5522-43-0 | 1-Nitropyrene

Chemical structure of 1-Nitropyrene, CAS 5522-43-0

AG003EKI

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CAS Number	5522-43-0
Catalog Number	AG003EKI(AGN-PC-0JKG1P)
Chemical Name	1-Nitropyrene
EC Number	226-868-2
IUPAC Name	1-nitropyrene
InChI	InChI=1S/C16H9NO2/c18-17(19)14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11/h1-9H
InChI Key	ALRLPDGCPYIVHP-UHFFFAOYSA-N
MDL Number	MFCD00004138
Molecular Formula	C16H9NO2
Molecular Weight	247.2482
NSC Number	81340
SMILES	O=[N+](C1=C(C2=C34)C=CC4=CC=CC3=CC=C2C=C1)[O-]
UNII	TD1665I8Q4
Synonyms	1-nitropyrene, 3-nitropyrene, 1-NITROPYRENE, 5522-43-0, 3-Nitropyrene, Pyrene, 1-nitro-, Pyrene, nitro-, NITROPYRENE, CCRIS 455, 1-Nitro-pyrene, UNII-TD1665I8Q4, HSDB 6980, EINECS 226-868-2, NSC 81340, BRN 1882811, 1-Nitropyrene [Nitroarenes], CHEBI:34107, ALRLPDGCPYIVHP-UHFFFAOYSA-N, TD1665I8Q4, 1-Nitropyrene [Polycyclic aromatic compounds], 1-Nitropyrene, 99%, AC1L2IVS, DSSTox_CID_983, ACMC-1B96I, DSSTox_RID_75905, NCIOpen2_004479, DSSTox_GSID_20983, 63021-86-3, BIDD:ER0532, SCHEMBL339725, CHEMBL167395, DTXSID6020983, CTK1H0615, ZINC157143, NSC81340, Tox21_200066, ANW-32263, MFCD00004138, NSC-81340, SBB058388, AKOS002384330, LS-1361, MCULE-1661621362, RTR-019475, NCGC00164217-01, NCGC00164217-02, NCGC00257620-01, AJ-14897, AK-86325, CC-04910, ZB006569, CAS-5522-43-0, AX8059897, DB-019312, LS-129450, ST2403489, TR-019475, FT-0658253, N0419, ST45023843, TL80073752, W6924, C14421, Y-9043, 522N430, C-30171, 1-Nitropyrene, BCR(R) certified Reference Material, I14-6774, I14-23155, Nitropyrenes, Nitropyrene, 1-, C16H9NO2, 1-Nitropyrene, 98% - 1G 1g, C16-H9-N-O2, CID21694, ZINC00157143, 4-05-00-02471 (Beilstein Handbook Reference), C032668,

Complexity	377
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	247.063g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	247.253g/mol
Monoisotopic Mass	247.063g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	45.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H350-H360
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Related Research Chemicals

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Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

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Reviewed by:Jessie

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Angene International Limited