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DCB

CAT: 0572-TRC-D195153-50MGSize: 50 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-D195153-50MGSize:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
6971-97-7
Synonyms
DCB
Hazard Statement
No Data Available
Smiles
Clc1cccc(\C=N\N=C\c2cccc(Cl)c2)c1
Molecular Formula
C14 H10 Cl2 N2
Molecular Weight
277.149
InChI
InChI=1S/C14H10Cl2N2/c15-13-5-1-3-11(7-13)9-17-18-10-12-4-2-6-14(16)8-12/h1-10H/b17-9+,18-10+

Chemical Information

Benzaldehyde, 3-chloro-, [(3-chlorophenyl)methylene]hydrazone

See also: 3,3'-Dichlorobenzaldazine (annotation moved to).

CAS Number6971-97-7
PubChem CID6861557
IUPAC Name(E)-1-(3-chlorophenyl)-N-[(E)-(3-chlorophenyl)methylideneamino]methanimine
Molecular FormulaC14H10Cl2N2
Molecular Weight277.1
XLogP4.6
Topological Polar Surface Area24.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count18
Formal Charge0
Complexity274
SMILES
C1=CC(=CC(=C1)Cl)/C=N/N=C/C2=CC(=CC=C2)Cl
InChI
InChI=1S/C14H10Cl2N2/c15-13-5-1-3-11(7-13)9-17-18-10-12-4-2-6-14(16)8-12/h1-10H/b17-9+,18-10+
InChIKey
XMOVWXSCYLINBJ-BEQMOXJMSA-N
Chemical Structure
2D Structure
2D structure of Benzaldehyde, 3-chloro-, [(3-chlorophenyl)methylene]hydrazone
CAS: 6971-97-7
CID: 6861557
Formula: C14H10Cl2N2
MW: 277.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight277.1
XLogP34.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass276.0221037
Monoisotopic Mass276.0221037
Topological Polar Surface Area24.7 Ų
Heavy Atom Count18
Formal Charge0
Complexity274
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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