AG00IC25

Name: Isopropyl(2-nitrophenyl)sulfane
Brand: Angene Chemical
SKU: AG00IC25

70415-85-9 | Isopropyl(2-nitrophenyl)sulfane

AG00IC25

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CAS Number	70415-85-9
Catalog Number	AG00IC25(AGN-PC-0NJ7C7)
Chemical Name	Isopropyl(2-nitrophenyl)sulfane
IUPAC Name	1-nitro-2-propan-2-ylsulfanylbenzene
InChI	InChI=1S/C9H11NO2S/c1-7(2)13-9-6-4-3-5-8(9)10(11)12/h3-7H,1-2H3
InChI Key	WRFYXBKJHZAUTO-UHFFFAOYSA-N
MDL Number	MFCD13689000
Molecular Formula	C9H11NO2S
Molecular Weight	197.2541
SMILES	S(C(C)C)c1c(cccc1)[N+](=O)[O-]
Synonyms	Isopropyl(2-nitrophenyl)sulfane, 70415-85-9, WRFYXBKJHZAUTO-UHFFFAOYSA-N, 1-Isopropylsulfanyl-2-nitro-benzene, 1-nitro-2-(propan-2-ylsulfanyl)benzene, 2-isopropylmercaptonitrobenzene, SCHEMBL2593514, 1-(Isopropylthio)-2-nitrobenzene, 2-nitrophenyl propan-2-yl sulfide, BCP18382, KS-000019VI, MFCD13689000, 1-nitro-2-propan-2-ylsulfanylbenzene, ZINC139769852, FCH2514751, AK162308, AX8294647, Benzene, 1-[(1-methylethyl)thio]-2-nitro-, 70415-86-0,

Complexity	179
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	197.051g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	197.252g/mol
Monoisotopic Mass	197.051g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	71.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited