CS-0644679
7'-Fluoro-6'-(trifluoromethyl)-2',3'-dihydro-1'H-spiro[cyclopropane-1,4'-isoquinolin]-1'-one
Manufacturer: ChemScene
CAS Number: 2771024-25-8
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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
C₁₂H₉F₄NO
Molecular Weight
259.20
Synonyms
None
SMILES
O=C1NCC2(C3=C1C=C(F)C(C(F)(F)F)=C3)CC2
Tpsa
29.1
Logp
2.6195
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: C₁₂H₉F₄NO
Molecular Weight: 259.20
Synonyms: None
SMILES: O=C1NCC2(C3=C1C=C(F)C(C(F)(F)F)=C3)CC2
Tpsa: 29.1
Logp: 2.6195
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:
C₁₂H₉F₄NO
Molecular Weight:
259.20
Synonyms:
None
SMILES:
O=C1NCC2(C3=C1C=C(F)C(C(F)(F)F)=C3)CC2
Tpsa:
29.1
Logp:
2.6195
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: C₅H₁₂Cl₂N₄
Molecular Weight: 199.08
Synonyms: None
SMILES: NNC1=CN(CC)N=C1.[H]Cl.[H]Cl
Tpsa: 55.87
Logp: 1.0322
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₁₂Cl₂N₄
Molecular Weight:
199.08
Synonyms:
None
SMILES:
NNC1=CN(CC)N=C1.[H]Cl.[H]Cl
Tpsa:
55.87
Logp:
1.0322
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄H₄F₂N₂O
Molecular Weight: 134.08
Synonyms: None
SMILES: FC(F)OC1=CNN=C1
Tpsa: 37.91
Logp: 1.0111
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₄F₂N₂O
Molecular Weight:
134.08
Synonyms:
None
SMILES:
FC(F)OC1=CNN=C1
Tpsa:
37.91
Logp:
1.0111
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₂₂N₂O₅
Molecular Weight: 322.36
Synonyms: None
SMILES: O=C(OC)[C@@H](NC(OCC1=CC=CC=C1)=O)C[C@H]2CNCCO2
Tpsa: 85.89
Logp: 0.8329
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₂N₂O₅
Molecular Weight:
322.36
Synonyms:
None
SMILES:
O=C(OC)[C@@H](NC(OCC1=CC=CC=C1)=O)C[C@H]2CNCCO2
Tpsa:
85.89
Logp:
0.8329
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
6