AG00DDSM

Name: 1-(3-nitrophenyl)butan-1-one
Brand: Angene Chemical
SKU: AG00DDSM

50766-86-4 | 1-(3-nitrophenyl)butan-1-one

AG00DDSM

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CAS Number	50766-86-4
Catalog Number	AG00DDSM(AGN-PC-0JMSTY)
Chemical Name	1-(3-nitrophenyl)butan-1-one
IUPAC Name	1-(3-nitrophenyl)butan-1-one
InChI	InChI=1S/C10H11NO3/c1-2-4-10(12)8-5-3-6-9(7-8)11(13)14/h3,5-7H,2,4H2,1H3
InChI Key	HJLRYDBRORTQIU-UHFFFAOYSA-N
MDL Number	MFCD00024523
Molecular Formula	C10H11NO3
Molecular Weight	193.1992
NSC Number	210921
SMILES	CCCC(C1=CC([N+]([O-])=O)=CC=C1)=O
Synonyms	50766-86-4, 1-(3-nitrophenyl)butan-1-one, 1-(3-Nitrophenyl)-1-butanone, 1-Butanone, 1-(3-nitrophenyl)-, 3'-Nitrobutyrophenone, m-Nitrobutyrophenone, 1-(3-Nitro-phenyl)-butan-1-one, NSC210921, AC1L3LRL, AC1Q2UEH, AC1Q2UF4, SCHEMBL568615, CTK4J3141, DTXSID90198804, 1-Butanone,1-(3-nitrophenyl)-, HJLRYDBRORTQIU-UHFFFAOYSA-N, ZINC1746599, AKOS000164095, MCULE-8514611884, NE10858, NSC-210921, AC-20422, AN-41431, FT-0656276, EN300-06507, 766N864, 3-Nitrobutyrophenone, CID142747,

Complexity	222
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	193.074g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	193.202g/mol
Monoisotopic Mass	193.074g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	62.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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