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2-Amino-5-chlorobenzophenone

CAT: 0572-TRC-A603490-50GSize: 50 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-A603490-50GSize:50 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
719-59-5
Synonyms
Alprazolam Imp. E (EP); Chlordiazepoxide Hydrochloride Imp. C (EP); Chlordiazepoxide Imp. C (EP); Dipotassium Clorazepate Imp. A (EP); Clorazepate Imp. A (EP); Oxazepam Imp. D (EP); Prazepam Imp. C (EP); (2-Amino-5-chlorophenyl)phenylmethanone; (2-amino-5-chlorophenyl)phenyl-methanone; Aminochlorobenzophenone; Alprazolam Impurity E; Chlordiazepoxide Hydrochloride Impurity C; Chlordiazepoxide Impurity C; Dipotassium Clorazepate Impurity A; Oxazepam Impurity D; Prazepam Impurity C; Chlordiazepoxide Impurity C; NSC 84157
Hazard Statement
Causes skin irritation
Purity
>95% (HPLC)
Smiles
Nc1ccc(Cl)cc1C(=O)c2ccccc2
Molecular Formula
C13 H10 Cl N O
Molecular Weight
231.68
InChI
InChI=1S/C13H10ClNO/c14-10-6-7-12(15)11(8-10)13(16)9-4-2-1-3-5-9/h1-8H,15H2
Additionnal Information
IUPAC name: (2-amino-5-chlorophenyl)-phenylmethanone
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

2-Amino-5-chlorobenzophenone
CAS Number719-59-5
PubChem CID12870
IUPAC Name(2-amino-5-chlorophenyl)-phenylmethanone
Molecular FormulaC13H10ClNO
Molecular Weight231.68
XLogP3.8
Topological Polar Surface Area43.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count16
Formal Charge0
Complexity250
SMILES
C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)N
InChI
InChI=1S/C13H10ClNO/c14-10-6-7-12(15)11(8-10)13(16)9-4-2-1-3-5-9/h1-8H,15H2
InChIKey
ZUWXHHBROGLWNH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Amino-5-chlorobenzophenone
CAS: 719-59-5
CID: 12870
Formula: C13H10ClNO
MW: 231.68
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight231.68
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass231.0450916
Monoisotopic Mass231.0450916
Topological Polar Surface Area43.1 Ų
Heavy Atom Count16
Formal Charge0
Complexity250
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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