7-chloro-4-(3-methylbut-2-enyl)-3-propan-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Modify Date: 2025-09-25 12:16:51

7-chloro-4-(3-methylbut-2-enyl)-3-propan-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Structure
7-chloro-4-(3-methylbut-2-enyl)-3-propan-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one structure
 Common Name 7-chloro-4-(3-methylbut-2-enyl)-3-propan-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one
CAS Number 258849-96-6 Molecular Weight 306.83000
Density 1.087g/cm3 Boiling Point 436.6ºC at 760 mmHg
Molecular Formula C17H23ClN2O Melting Point N/A
MSDS N/A Flash Point 217.8ºC

 Names

Name 7-chloro-4-(3-methylbut-2-enyl)-3-propan-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.087g/cm3
Boiling Point 436.6ºC at 760 mmHg
Molecular Formula C17H23ClN2O
Molecular Weight 306.83000
Flash Point 217.8ºC
Exact Mass 306.15000
PSA 32.34000
LogP 4.16080
Vapour Pressure 7.99E-08mmHg at 25°C
Index of Refraction 1.531
InChIKey ZPOKQPFGUTYRET-UHFFFAOYSA-N
SMILES CC(C)=CCN1Cc2cc(Cl)ccc2NC(=O)C1C(C)C

 Synthetic Route

3,3-Dimethylallyl bromide structure

3,3-Dimethylall...

CAS#:870-63-3

7-chloro-3-propan-2-yl-1,3,4,5-tetrahydro-1,4-benzodiazepin-2-one structure

7-chloro-3-prop...

CAS#:258850-11-2

~75%

7-chloro-4-(3-methylbut-2-enyl)-3-propan-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Structure

7-chloro-4-(3-m...

CAS#:258849-96-6

Literature: Breslin, Henry J.; Kukla, Michael J.; Kromis, Teresa; Cullis, Heather; De Knaep, Fons; Pauwels, Rudi; Andries, Koen; De Clercq, Erik; Janssen, Marcel A.C.; Janssen, Paul A.J. Bioorganic and Medicinal Chemistry, 1999 , vol. 7, # 11 p. 2427 - 2436
5-Chloro-2-nitrobenzyl alcohol structure

5-Chloro-2-nitr...

CAS#:73033-58-6

~%

7-chloro-4-(3-methylbut-2-enyl)-3-propan-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Structure

7-chloro-4-(3-m...

CAS#:258849-96-6

Literature: Breslin, Henry J.; Kukla, Michael J.; Kromis, Teresa; Cullis, Heather; De Knaep, Fons; Pauwels, Rudi; Andries, Koen; De Clercq, Erik; Janssen, Marcel A.C.; Janssen, Paul A.J. Bioorganic and Medicinal Chemistry, 1999 , vol. 7, # 11 p. 2427 - 2436
DL-Valine Methyl Ester Hydrochloride structure

DL-Valine Methy...

CAS#:5619-05-6

~%

7-chloro-4-(3-methylbut-2-enyl)-3-propan-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Structure

7-chloro-4-(3-m...

CAS#:258849-96-6

Literature: Breslin, Henry J.; Kukla, Michael J.; Kromis, Teresa; Cullis, Heather; De Knaep, Fons; Pauwels, Rudi; Andries, Koen; De Clercq, Erik; Janssen, Marcel A.C.; Janssen, Paul A.J. Bioorganic and Medicinal Chemistry, 1999 , vol. 7, # 11 p. 2427 - 2436
5-chloro-2-nitrobenzyl methanesulfonate structure

5-chloro-2-nitr...

CAS#:209688-13-1

~%

7-chloro-4-(3-methylbut-2-enyl)-3-propan-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Structure

7-chloro-4-(3-m...

CAS#:258849-96-6

Literature: Breslin, Henry J.; Kukla, Michael J.; Kromis, Teresa; Cullis, Heather; De Knaep, Fons; Pauwels, Rudi; Andries, Koen; De Clercq, Erik; Janssen, Marcel A.C.; Janssen, Paul A.J. Bioorganic and Medicinal Chemistry, 1999 , vol. 7, # 11 p. 2427 - 2436
N/A structure

N/A

CAS#:258850-15-6

~%

7-chloro-4-(3-methylbut-2-enyl)-3-propan-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Structure

7-chloro-4-(3-m...

CAS#:258849-96-6

Literature: Breslin, Henry J.; Kukla, Michael J.; Kromis, Teresa; Cullis, Heather; De Knaep, Fons; Pauwels, Rudi; Andries, Koen; De Clercq, Erik; Janssen, Marcel A.C.; Janssen, Paul A.J. Bioorganic and Medicinal Chemistry, 1999 , vol. 7, # 11 p. 2427 - 2436
(+/-)-methyl 2-[[(2-amino-5-chlorophenyl)methyl]amino]-3-methylbutanoate structure

(+/-)-methyl 2-...

CAS#:258850-20-3

~%

7-chloro-4-(3-methylbut-2-enyl)-3-propan-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Structure

7-chloro-4-(3-m...

CAS#:258849-96-6

Literature: Breslin, Henry J.; Kukla, Michael J.; Kromis, Teresa; Cullis, Heather; De Knaep, Fons; Pauwels, Rudi; Andries, Koen; De Clercq, Erik; Janssen, Marcel A.C.; Janssen, Paul A.J. Bioorganic and Medicinal Chemistry, 1999 , vol. 7, # 11 p. 2427 - 2436

 Synonyms

2H-1,4-Benzodiazepin-2-one,7-chloro-1,3,4,5-tetrahydro-4-(3-methyl-2-butenyl)-3-(1-methylethyl)
7-chloro-4-(3-methylbut-2-en-1-yl)-3-(1-methylethyl)-1,3,4,5-tetrahydro-2h-1,4-benzodiazepin-2-one
7-Chloro-3-isopropyl-4-(3-methyl-but-2-enyl)-1,3,4,5-tetrahydro-1,4-benzodiazepin-2-one
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Chemsrc provides CAS#:258849-96-6 MSDS, density, melting point, boiling point, structure, etc. Its name is 7-chloro-4-(3-methylbut-2-enyl)-3-propan-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one>> amp version: 7-chloro-4-(3-methylbut-2-enyl)-3-propan-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

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