CS-0800458
3-Chloro-2-[5-(P-tolyl)pent-4-enyl]isoquinolin-1-one
Manufacturer: ChemScene
CAS Number: 1330074-84-4
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₁H₂₀ClNO
Molecular Weight
337.84
Synonyms
None
SMILES
CC1=CC=C(C=CCCCN2C(=O)C3C(=CC=CC=3)C=C2Cl)C=C1
Tpsa
22
Logp
5.45692
H Acceptors
2
H Donors
0
Rotatable Bonds
5
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₂₀ClNO
Molecular Weight: 337.84
Synonyms: None
SMILES: CC1=CC=C(C=CCCCN2C(=O)C3C(=CC=CC=3)C=C2Cl)C=C1
Tpsa: 22
Logp: 5.45692
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₀ClNO
Molecular Weight:
337.84
Synonyms:
None
SMILES:
CC1=CC=C(C=CCCCN2C(=O)C3C(=CC=CC=3)C=C2Cl)C=C1
Tpsa:
22
Logp:
5.45692
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₁₈ClNO
Molecular Weight: 323.82
Synonyms: None
SMILES: CC1=CC=C(C=CCCN2C(=O)C3C(=CC=CC=3)C=C2Cl)C=C1
Tpsa: 22
Logp: 5.06682
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₁₈ClNO
Molecular Weight:
323.82
Synonyms:
None
SMILES:
CC1=CC=C(C=CCCN2C(=O)C3C(=CC=CC=3)C=C2Cl)C=C1
Tpsa:
22
Logp:
5.06682
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₇NO₃
Molecular Weight: 247.29
Synonyms: None
SMILES: COC1C=C2C(=O)N(CC(C)O)C(C)=CC2=CC=1
Tpsa: 51.46
Logp: 1.69932
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₇NO₃
Molecular Weight:
247.29
Synonyms:
None
SMILES:
COC1C=C2C(=O)N(CC(C)O)C(C)=CC2=CC=1
Tpsa:
51.46
Logp:
1.69932
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₀BrCl₂N₃
Molecular Weight: 286.98
Synonyms: None
SMILES: Cl.Cl.BrC1=CN=C(N=C1)C2(N)CC2
Tpsa: 51.8
Logp: 2.0305
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₀BrCl₂N₃
Molecular Weight:
286.98
Synonyms:
None
SMILES:
Cl.Cl.BrC1=CN=C(N=C1)C2(N)CC2
Tpsa:
51.8
Logp:
2.0305
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1