CS-0433771
6-Chloro-7-fluoro-3,4-dihydroisoquinolin-1(2H)-one
Manufacturer: ChemScene
CAS Number: 1394003-70-3
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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
C₉H₇ClFNO
Molecular Weight
199.61
Synonyms
None
SMILES
O=C1NCCC2=C1C=C(F)C(Cl)=C2
Tpsa
29.1
Logp
1.765
H Acceptors
1
H Donors
1
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: C₉H₇ClFNO
Molecular Weight: 199.61
Synonyms: None
SMILES: O=C1NCCC2=C1C=C(F)C(Cl)=C2
Tpsa: 29.1
Logp: 1.765
H Acceptors: 1
H Donors: 1
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:
C₉H₇ClFNO
Molecular Weight:
199.61
Synonyms:
None
SMILES:
O=C1NCCC2=C1C=C(F)C(Cl)=C2
Tpsa:
29.1
Logp:
1.765
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
0
Purity: 95%
MDL No: MFCD11974895
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₅Cl₂N₃
Molecular Weight: 224.13
Synonyms: None
SMILES: [H]Cl.[H]Cl.N1(C[C@@H]2NCCC2)C=CN=C1
Tpsa: 29.85
Logp: 1.4787
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
MFCD11974895
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₅Cl₂N₃
Molecular Weight:
224.13
Synonyms:
None
SMILES:
[H]Cl.[H]Cl.N1(C[C@@H]2NCCC2)C=CN=C1
Tpsa:
29.85
Logp:
1.4787
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: MFCD18252694
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₂₅NO₂
Molecular Weight: 227.34
Synonyms: None
SMILES: CC(C)(C)OC([C@H](N)CC1CCCCC1)=O
Tpsa: 52.32
Logp: 2.6258
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 3
Purity:
95%
MDL No:
MFCD18252694
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₂₅NO₂
Molecular Weight:
227.34
Synonyms:
None
SMILES:
CC(C)(C)OC([C@H](N)CC1CCCCC1)=O
Tpsa:
52.32
Logp:
2.6258
H Acceptors:
3
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: C₁₂H₂₀FNO₄
Molecular Weight: 261.29
Synonyms: None
SMILES: FC1C(OC(C)=O)CCN(C(OC(C)(C)C)=O)C1
Tpsa: 55.84
Logp: 1.897
H Acceptors: 4
H Donors: 0
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:
C₁₂H₂₀FNO₄
Molecular Weight:
261.29
Synonyms:
None
SMILES:
FC1C(OC(C)=O)CCN(C(OC(C)(C)C)=O)C1
Tpsa:
55.84
Logp:
1.897
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
1