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Benzocycloheptapyridines

Organic polycyclic compounds that consist of a central seven-membered carbon ring fused with both a pyridine and a benzene.
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1

Thermo Scientific Chemicals Desloratadine

CAS: 100643-71-8 Molecular Formula: C19H19ClN2 Molecular Weight (g/mol): 310.83 InChI Key: JAUOIFJMECXRGI-UHFFFAOYSA-N IUPAC Name: 13-chloro-2-(piperidin-4-ylidene)-4-azatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3,5,7,11,13-hexaene SMILES: ClC1=CC=C2C(CCC3=CC=CN=C3C2=C2CCNCC2)=C1

CAS 100643-71-8
Molecular Weight (g/mol) 310.83
SMILES ClC1=CC=C2C(CCC3=CC=CN=C3C2=C2CCNCC2)=C1
IUPAC Name 13-chloro-2-(piperidin-4-ylidene)-4-azatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3,5,7,11,13-hexaene
InChI Key JAUOIFJMECXRGI-UHFFFAOYSA-N
Molecular Formula C19H19ClN2
2

Loratadine, 98+%

CAS: 79794-75-5 Molecular Formula: C22H23ClN2O2 Molecular Weight (g/mol): 382.888 MDL Number: MFCD00672869 InChI Key: JCCNYMKQOSZNPW-UHFFFAOYSA-N Synonym: loratadine,claritin,loratidine,alavert,clarityn,lisino,clarityne,loracert,loradex,bonalerg PubChem CID: 3957 IUPAC Name: ethyl 4-(8-chloro-5,6-dihydrobenzo[1,2]cyclohepta[2,4-b]pyridin-11-ylidene)piperidine-1-carboxylate SMILES: CCOC(=O)N1CCC(=C2C3=C(CCC4=C2N=CC=C4)C=C(C=C3)Cl)CC1

PubChem CID 3957
CAS 79794-75-5
Molecular Weight (g/mol) 382.888
MDL Number MFCD00672869
SMILES CCOC(=O)N1CCC(=C2C3=C(CCC4=C2N=CC=C4)C=C(C=C3)Cl)CC1
Synonym loratadine,claritin,loratidine,alavert,clarityn,lisino,clarityne,loracert,loradex,bonalerg
IUPAC Name ethyl 4-(8-chloro-5,6-dihydrobenzo[1,2]cyclohepta[2,4-b]pyridin-11-ylidene)piperidine-1-carboxylate
InChI Key JCCNYMKQOSZNPW-UHFFFAOYSA-N
Molecular Formula C22H23ClN2O2
3

Loratadine, USP, 98.5-101%, Spectrum™ Chemical
SDP

CAS: 79794-75-5 Molecular Formula: C22H23ClN2O2 Molecular Weight (g/mol): 382.89 InChI Key: JCCNYMKQOSZNPW-UHFFFAOYSA-N IUPAC Name: ethyl 4-{13-chloro-4-azatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3,5,7,11,13-hexaen-2-ylidene}piperidine-1-carboxylate SMILES: CCOC(=O)N1CCC(CC1)=C1C2=CC=C(Cl)C=C2CCC2=CC=CN=C12

CAS 79794-75-5
Molecular Weight (g/mol) 382.89
SMILES CCOC(=O)N1CCC(CC1)=C1C2=CC=C(Cl)C=C2CCC2=CC=CN=C12
IUPAC Name ethyl 4-{13-chloro-4-azatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3,5,7,11,13-hexaen-2-ylidene}piperidine-1-carboxylate
InChI Key JCCNYMKQOSZNPW-UHFFFAOYSA-N
Molecular Formula C22H23ClN2O2
4

Loratadine 98.0+%, TCI America™

CAS: 79794-75-5 Molecular Formula: C22H23ClN2O2 Molecular Weight (g/mol): 382.888 MDL Number: MFCD00672869 InChI Key: JCCNYMKQOSZNPW-UHFFFAOYSA-N Synonym: loratadine,claritin,loratidine,alavert,clarityn,lisino,clarityne,loracert,loradex,bonalerg PubChem CID: 3957 IUPAC Name: ethyl 4-(8-chloro-5,6-dihydrobenzo[1,2]cyclohepta[2,4-b]pyridin-11-ylidene)piperidine-1-carboxylate SMILES: CCOC(=O)N1CCC(=C2C3=C(CCC4=C2N=CC=C4)C=C(C=C3)Cl)CC1

PubChem CID 3957
CAS 79794-75-5
Molecular Weight (g/mol) 382.888
MDL Number MFCD00672869
SMILES CCOC(=O)N1CCC(=C2C3=C(CCC4=C2N=CC=C4)C=C(C=C3)Cl)CC1
Synonym loratadine,claritin,loratidine,alavert,clarityn,lisino,clarityne,loracert,loradex,bonalerg
IUPAC Name ethyl 4-(8-chloro-5,6-dihydrobenzo[1,2]cyclohepta[2,4-b]pyridin-11-ylidene)piperidine-1-carboxylate
InChI Key JCCNYMKQOSZNPW-UHFFFAOYSA-N
Molecular Formula C22H23ClN2O2
5

Desloratadine 98.0+%, TCI America™

CAS: 100643-71-8 Molecular Formula: C19H19ClN2 Molecular Weight (g/mol): 310.825 MDL Number: MFCD00871949 InChI Key: JAUOIFJMECXRGI-UHFFFAOYSA-N PubChem CID: 124087 ChEBI: CHEBI:291342 IUPAC Name: 8-chloro-11-piperidin-4-ylidene-5,6-dihydrobenzo[1,2]cyclohepta[2,4-b]pyridine SMILES: C1CC2=C(C=CC(=C2)Cl)C(=C3CCNCC3)C4=C1C=CC=N4

PubChem CID 124087
CAS 100643-71-8
Molecular Weight (g/mol) 310.825
ChEBI CHEBI:291342
MDL Number MFCD00871949
SMILES C1CC2=C(C=CC(=C2)Cl)C(=C3CCNCC3)C4=C1C=CC=N4
IUPAC Name 8-chloro-11-piperidin-4-ylidene-5,6-dihydrobenzo[1,2]cyclohepta[2,4-b]pyridine
InChI Key JAUOIFJMECXRGI-UHFFFAOYSA-N
Molecular Formula C19H19ClN2
6

8-Chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-one 98.0+%, TCI America™

CAS: 31251-41-9 Molecular Formula: C14H10ClNO Molecular Weight (g/mol): 243.69 MDL Number: MFCD00800222 InChI Key: WMQNOYVVLMIZDV-UHFFFAOYSA-N Synonym: 8-Chloro-5H-benzo[5,6]cyclohepta[1,2-b]pyridin-11(6H)-one PubChem CID: 9816260 IUPAC Name: 8-chloro-5,6-dihydrobenzo[1,2]cyclohepta[2,4-b]pyridin-11-one SMILES: C1CC2=C(C=CC(=C2)Cl)C(=O)C3=C1C=CC=N3

PubChem CID 9816260
CAS 31251-41-9
Molecular Weight (g/mol) 243.69
MDL Number MFCD00800222
SMILES C1CC2=C(C=CC(=C2)Cl)C(=O)C3=C1C=CC=N3
Synonym 8-Chloro-5H-benzo[5,6]cyclohepta[1,2-b]pyridin-11(6H)-one
IUPAC Name 8-chloro-5,6-dihydrobenzo[1,2]cyclohepta[2,4-b]pyridin-11-one
InChI Key WMQNOYVVLMIZDV-UHFFFAOYSA-N
Molecular Formula C14H10ClNO