CS-1063303
1,3-Dichloro-7-(prop-1-yn-1-yl)isoquinoline
Manufacturer: ChemScene
CAS Number: 2577600-12-3
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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
C₁₂H₇Cl₂N
Molecular Weight
236.10
Synonyms
None
SMILES
ClC=1N=C(Cl)C=2C=C(C#CC)C=CC2C1
Tpsa
12.89
Logp
3.913
H Acceptors
1
H Donors
0
Rotatable Bonds
0
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: C₁₂H₇Cl₂N
Molecular Weight: 236.10
Synonyms: None
SMILES: ClC=1N=C(Cl)C=2C=C(C#CC)C=CC2C1
Tpsa: 12.89
Logp: 3.913
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₇Cl₂N
Molecular Weight:
236.10
Synonyms:
None
SMILES:
ClC=1N=C(Cl)C=2C=C(C#CC)C=CC2C1
Tpsa:
12.89
Logp:
3.913
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₈ClF₃N₆
Molecular Weight: 280.64
Synonyms: None
SMILES: FC(F)(F)C(N)(C1=NC=2N=C(N=C(Cl)C2N1)N)C
Tpsa: 106.5
Logp: 1.3247
H Acceptors: 5
H Donors: 3
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:
C₈H₈ClF₃N₆
Molecular Weight:
280.64
Synonyms:
None
SMILES:
FC(F)(F)C(N)(C1=NC=2N=C(N=C(Cl)C2N1)N)C
Tpsa:
106.5
Logp:
1.3247
H Acceptors:
5
H Donors:
3
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: C₁₃H₂₄N₂O₂
Molecular Weight: 240.34
Synonyms: None
SMILES: N1=C(C=C(OCC)N1CCCOC)C(C)CC
Tpsa: 36.28
Logp: 2.8318
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₂₄N₂O₂
Molecular Weight:
240.34
Synonyms:
None
SMILES:
N1=C(C=C(OCC)N1CCCOC)C(C)CC
Tpsa:
36.28
Logp:
2.8318
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₉ClF₃N₅O
Molecular Weight: 295.65
Synonyms: None
SMILES: FC(F)(F)C(OCC1=NC=2N=CN=C(Cl)C2N1)CN
Tpsa: 89.71
Logp: 1.4125
H Acceptors: 5
H Donors: 2
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:
C₉H₉ClF₃N₅O
Molecular Weight:
295.65
Synonyms:
None
SMILES:
FC(F)(F)C(OCC1=NC=2N=CN=C(Cl)C2N1)CN
Tpsa:
89.71
Logp:
1.4125
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
4