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Structure

3,8-Dichloro-6,11-dihydro-5H-dibenzo[c,f][1,2]diazepine

CAS
955-66-8
Catalog Number
ACM955668
Category
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What is the molecular formula of 3,8-Dichloro-6,11-dihydro-5H-dibenzo[c,f][1,2]diazepine?

The molecular formula is C13H10Cl2N2.

What are the synonyms for 3,8-Dichloro-6,11-dihydro-5H-dibenzo[c,f][1,2]diazepine?

The synonyms are 3,8-Dichloro-6,11-dihydro-5H-dibenzo[c,f][1,2]diazepine, 955-66-8, KNCSFVPWGXYVKA-UHFFFAOYSA-N, and 5H-Dibenzo[c,f][1,2]diazepine, 3,8-dichloro-6,11-dihydro-.

What is the molecular weight of 3,8-Dichloro-6,11-dihydro-5H-dibenzo[c,f][1,2]diazepine?

The molecular weight is 265.13 g/mol.

What is the IUPAC name of 3,8-Dichloro-6,11-dihydro-5H-dibenzo[c,f][1,2]diazepine?

The IUPAC name is 3,8-dichloro-6,11-dihydro-5H-benzo[c][1,2]benzodiazepine.

What is the InChI of 3,8-Dichloro-6,11-dihydro-5H-dibenzo[c,f][1,2]diazepine?

The InChI is InChI=1S/C13H10Cl2N2/c14-10-3-1-8-5-9-2-4-11(15)7-13(9)17-16-12(8)6-10/h1-4,6-7,16-17H,5H2.

What is the InChIKey of 3,8-Dichloro-6,11-dihydro-5H-dibenzo[c,f][1,2]diazepine?

The InChIKey is KNCSFVPWGXYVKA-UHFFFAOYSA-N.

What is the canonical SMILES of 3,8-Dichloro-6,11-dihydro-5H-dibenzo[c,f][1,2]diazepine?

The canonical SMILES is C1C2=C(C=C(C=C2)Cl)NNC3=C1C=CC(=C3)Cl.

What is the XLogP3-AA value of 3,8-Dichloro-6,11-dihydro-5H-dibenzo[c,f][1,2]diazepine?

The XLogP3-AA value is 5.

How many Hydrogen Bond Donor Count does 3,8-Dichloro-6,11-dihydro-5H-dibenzo[c,f][1,2]diazepine have?

It has 2 Hydrogen Bond Donor Count.

How many Rotatable Bond Count does 3,8-Dichloro-6,11-dihydro-5H-dibenzo[c,f][1,2]diazepine have?

It has 0 Rotatable Bond Count.

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