AG00CRA5

Name: 1-(1-Chloroethyl)-3-nitrobenzene
Brand: Angene Chemical
SKU: AG00CRA5

34586-27-1 | 1-(1-Chloroethyl)-3-nitrobenzene

AG00CRA5

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CAS Number	34586-27-1
Catalog Number	AG00CRA5(AGN-PC-00KK1P)
Chemical Name	1-(1-Chloroethyl)-3-nitrobenzene
IUPAC Name	1-(1-chloroethyl)-3-nitrobenzene
InChI	InChI=1S/C8H8ClNO2/c1-6(9)7-3-2-4-8(5-7)10(11)12/h2-6H,1H3
InChI Key	QRWUNNJGVSGUAF-UHFFFAOYSA-N
MDL Number	MFCD07343852
Molecular Formula	C8H8ClNO2
Molecular Weight	185.6076
SMILES	CC(C1=CC([N+]([O-])=O)=CC=C1)Cl
Synonyms	1-(1-chloroethyl)-3-nitrobenzene, 34586-27-1, AC1Q2AZG, SCHEMBL3384133, CTK4H2665, DTXSID70515954, QRWUNNJGVSGUAF-UHFFFAOYSA-N, alpha-methyl-3-nitrobenzyl chloride, 1-(1-Chloro-ethyl)-3-nitro-benzene, AKOS009029096, Benzene,1-(1-chloroethyl)-3-nitro-, MCULE-2953957029, NE28526, EN300-14438, 1- -3-NITROBENZENE,

Complexity	169
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	185.024g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	185.607g/mol
Monoisotopic Mass	185.024g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	45.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.8

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