CS-0370704
3-Oxo-3-(4-(trifluoromethyl)bicyclo[2.2.1]heptan-1-yl)propanenitrile
Manufacturer: ChemScene
CAS Number: 2737246-39-6
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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
C₁₁H₁₂F₃NO
Molecular Weight
231.21
Synonyms
None
SMILES
N#CCC(C12CCC(C2)(C(F)(F)F)CC1)=O
Tpsa
40.86
Logp
2.98198
H Acceptors
2
H Donors
0
Rotatable Bonds
2
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: C₁₁H₁₂F₃NO
Molecular Weight: 231.21
Synonyms: None
SMILES: N#CCC(C12CCC(C2)(C(F)(F)F)CC1)=O
Tpsa: 40.86
Logp: 2.98198
H Acceptors: 2
H Donors: 0
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:
C₁₁H₁₂F₃NO
Molecular Weight:
231.21
Synonyms:
None
SMILES:
N#CCC(C12CCC(C2)(C(F)(F)F)CC1)=O
Tpsa:
40.86
Logp:
2.98198
H Acceptors:
2
H Donors:
0
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: C₁₃H₁₀F₃NO₃
Molecular Weight: 285.22
Synonyms: None
SMILES: O=C(C1=CC(OC)=C2N=CC(C(F)(F)F)=CC2=C1)OC
Tpsa: 48.42
Logp: 3.0488
H Acceptors: 4
H Donors: 0
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:
C₁₃H₁₀F₃NO₃
Molecular Weight:
285.22
Synonyms:
None
SMILES:
O=C(C1=CC(OC)=C2N=CC(C(F)(F)F)=CC2=C1)OC
Tpsa:
48.42
Logp:
3.0488
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: RT, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₃NO₄
Molecular Weight: 187.19
Synonyms: None
SMILES: O=C(C1NC(CC1)C(OC)=O)OC
Tpsa: 64.63
Logp: -0.547
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 2
Purity:
97%
MDL No:
None
Storage:
RT, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₃NO₄
Molecular Weight:
187.19
Synonyms:
None
SMILES:
O=C(C1NC(CC1)C(OC)=O)OC
Tpsa:
64.63
Logp:
-0.547
H Acceptors:
5
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: C₁₅H₁₉BrN₂O₃
Molecular Weight: 355.23
Synonyms: INDEX NAME NOT YET ASSIGNED
SMILES: O=C1NCC2=C(CN(C)C(OC(C)(C)C)=O)C=C(Br)C=C21
Tpsa: 58.64
Logp: 3.0594
H Acceptors: 3
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:
C₁₅H₁₉BrN₂O₃
Molecular Weight:
355.23
Synonyms:
INDEX NAME NOT YET ASSIGNED
SMILES:
O=C1NCC2=C(CN(C)C(OC(C)(C)C)=O)C=C(Br)C=C21
Tpsa:
58.64
Logp:
3.0594
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2