AG00I6RY

34312-77-1 | Thiophene, 2-[(1E)-2-nitroethenyl]-

AG00I6RY

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CAS Number	34312-77-1
Catalog Number	AG00I6RY(AGN-PC-0O94HC)
Chemical Name	Thiophene, 2-[(1E)-2-nitroethenyl]-
EC Number	212-867-4
IUPAC Name	2-[(E)-2-nitroethenyl]thiophene
InChI	InChI=1S/C6H5NO2S/c8-7(9)4-3-6-2-1-5-10-6/h1-5H/b4-3+
InChI Key	UTPOWFFIBWOQRK-ONEGZZNKSA-N
MDL Number	MFCD00069434
Molecular Formula	C6H5NO2S
Molecular Weight	155.1744
NSC Number	22059
SMILES	O=[N+](/C=C/C1=CC=CS1)[O-]
Synonyms	2-(2-Nitrovinyl)thiophene, 34312-77-1, 874-84-0, (E)-2-(2-Nitroethenyl)thiophene, trans-2-(2-nitrovinyl)thiophene, 2-[(E)-2-nitroethenyl]thiophene, 2-(2-Nitroethenyl)thiophene, 2-[(E)-2-Nitrovinyl]thiophene, (E)-2-(2-NITROVINYL)THIOPHENE, 2-Thienylnitroethylene, 1-(2-Thienyl)-2-nitroethene, 2-NITROVINYLTHIOPHENE, Thiophene, 2-(2-nitrovinyl)-, EINECS 212-867-4, NSC 22059, 2-((1E)-2-nitrovinyl)thiophene, MFCD00069434, Thiophene, 2-(2-nitroethenyl)-, NSC22059, PubChem9976, AC1LEJRK, Thiophene, 2-(2-nitroethenyl)- (9CI), AC1Q5AAK, 2-(B-nitrovinyl)thiophene, Cambridge id 5102115, BIDD:GT0506, SCHEMBL793327, SCHEMBL807821, UTPOWFFIBWOQRK-ONEGZZNKSA-, ZINC55258, trans-2-(2-Nitroethenly)thiophene, 2-[(E)-2-nitro-vinyl]-thiophene, CCG-2016, CN-150, NSC-22059, SBB000122, AKOS000265916, AKOS017269078, AC-7892, AN-8541, PB13001, RP21946, VT20144, Thiophene, 2-[(1E)-2-nitroethenyl]-, AJ-09217, AN-47879, AS-36129, ST003142, ZB001602, AB0074331, AB1008549, DB-017585, LS-153143, ST2414396, ST2416053, TC-060287, TC-127574, CS-0052105, TL80073673, Z2091, Z2203, AZ0001-0015, C-8164, A842241, AB-337/25021025, I09-0227, Q-101288, W-104020, I14-14231, F2147-0416, InChI=1/C6H5NO2S/c8-7(9)4-3-6-2-1-5-10-6/h1-5H/b4-3+, null, C6H5NO2S, 2-[ -2-Nitrovinyl]thiophene, C6-H5-N-O2-S, 2-((E)-2-Nitro-vinyl)-thiophene, AR-1C6934, CID687329, CB11785, trans-2-(2-Nitrovinyl)thiophene, 99% - 1G 1g, 93658-27-6,

Complexity	152
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	155.004g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	155.171g/mol
Monoisotopic Mass	155.004g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	74.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P301+P310-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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