2-Chloro-4-nitro benzamide

CAT: 0926-FC41663-01Size: 10 gDry Ice: NoHazardous: No

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CAT#:0926-FC41663-01Size:10 g

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CAS Number

3011-89-0

MDL Number

MFCD00017119

Smiles

C1=CC (=C (C=C1[N+] (=O) [O-]) Cl) C (=O) N

Molecular Formula

C7H5ClN2O3

Molecular Weight

200.58 g/mol

Controlled

Chemical Information

Aklomide

2-chloro-4-nitrobenzamide is an organohalogen compound and a carbonyl compound.

CAS Number	3011-89-0
PubChem CID	2075
IUPAC Name	2-chloro-4-nitrobenzamide
Molecular Formula	C7H5ClN2O3
Molecular Weight	200.58
XLogP	1.4
Topological Polar Surface Area	88.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	13
Formal Charge	0
Complexity	228

SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Cl)C(=O)N

InChI

InChI=1S/C7H5ClN2O3/c8-6-3-4(10(12)13)1-2-5(6)7(9)11/h1-3H,(H2,9,11)

InChIKey

GFGSZUNNBQXGMK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 3011-89-0

CID: 2075

Formula: C7H5ClN2O3

MW: 200.58

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	200.58
XLogP3	1.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	199.9988697
Monoisotopic Mass	199.9988697
Topological Polar Surface Area	88.9 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	228
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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