CS-0644648
rel-(1R,2S)-6'-Bromo-2-fluoro-2',3'-dihydro-1'H-spiro[cyclopropane-1,4'-isoquinolin]-1'-one
Manufacturer: ChemScene
CAS Number: 2771023-29-9
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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
C₁₁H₉BrFNO
Molecular Weight
270.10
Synonyms
None
SMILES
O=C1NC[C@@]2(C3=C1C=CC(Br)=C3)[C@@H](F)C2
Tpsa
29.1
Logp
2.1721
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: C₁₁H₉BrFNO
Molecular Weight: 270.10
Synonyms: None
SMILES: O=C1NC[C@@]2(C3=C1C=CC(Br)=C3)[C@@H](F)C2
Tpsa: 29.1
Logp: 2.1721
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:
C₁₁H₉BrFNO
Molecular Weight:
270.10
Synonyms:
None
SMILES:
O=C1NC[C@@]2(C3=C1C=CC(Br)=C3)[C@@H](F)C2
Tpsa:
29.1
Logp:
2.1721
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: C₄H₅IN₂O
Molecular Weight: 224.00
Synonyms: None
SMILES: O=C1NN(C)C=C1I
Tpsa: 37.79
Logp: 0.318
H Acceptors: 2
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:
C₄H₅IN₂O
Molecular Weight:
224.00
Synonyms:
None
SMILES:
O=C1NN(C)C=C1I
Tpsa:
37.79
Logp:
0.318
H Acceptors:
2
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: C₁₃H₁₅NO₃
Molecular Weight: 233.26
Synonyms: None
SMILES: CCC1=COC(N1CC2=CC=C(C=C2)OC)=O
Tpsa: 44.37
Logp: 2.0606
H Acceptors: 4
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:
C₁₃H₁₅NO₃
Molecular Weight:
233.26
Synonyms:
None
SMILES:
CCC1=COC(N1CC2=CC=C(C=C2)OC)=O
Tpsa:
44.37
Logp:
2.0606
H Acceptors:
4
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: C₁₃H₁₅BClF₃O₃
Molecular Weight: 322.52
Synonyms: None
SMILES: CC1(C)C(C)(C)OB(C2=CC=C(OC(F)F)C(Cl)=C2F)O1
Tpsa: 27.69
Logp: 3.3797
H Acceptors: 3
H Donors: 0
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:
C₁₃H₁₅BClF₃O₃
Molecular Weight:
322.52
Synonyms:
None
SMILES:
CC1(C)C(C)(C)OB(C2=CC=C(OC(F)F)C(Cl)=C2F)O1
Tpsa:
27.69
Logp:
3.3797
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3