AG00C6KU

3970-41-0 | 2-Chloro-3-nitroaniline

AG00C6KU

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WARNING This product is not for human or veterinary use.

CAS Number	3970-41-0
Catalog Number	AG00C6KU(AGN-PC-000QZN)
Chemical Name	2-Chloro-3-nitroaniline
IUPAC Name	2-chloro-3-nitroaniline
InChI	InChI=1S/C6H5ClN2O2/c7-6-4(8)2-1-3-5(6)9(10)11/h1-3H,8H2
InChI Key	CMYQDOILKQVRGN-UHFFFAOYSA-N
MDL Number	MFCD00800473
Molecular Formula	C6H5ClN2O2
Molecular Weight	172.5691
SMILES	NC1=CC=CC([N+]([O-])=O)=C1Cl
Synonyms	2-Chloro-3-nitroaniline, 3970-41-0, 2-CHLORO-3-NITROBENZENAMINE, 3-nitro-2-chloroaniline, 2-Chloro-3-nitro anilin, SCHEMBL532321, Benzenamine,2-chloro-3-nitro-, CTK4I1746, KS-00000MXT, DTXSID80557542, CMYQDOILKQVRGN-UHFFFAOYSA-N, CS-B1097, ZINC2570060, MFCD00800473, AKOS006271436, RP23480, AJ-41820, AK-74206, DS-15685, AB0071248, ST2416683, 4CH-015094, FT-0719425, W-2664, J-508678, ACN-052122,

Complexity	159
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.004g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	172.568g/mol
Monoisotopic Mass	172.004g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	71.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number