CS-0801104
4-Bromo-2-(3-cyanooxetan-3-yl)benzoic acid
Manufacturer: ChemScene
CAS Number: 2771024-37-2
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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
C₁₁H₈BrNO₃
Molecular Weight
282.09
Synonyms
None
SMILES
BrC1=CC(=C(C=C1)C(O)=O)C2(C#N)COC2
Tpsa
70.32
Logp
1.93888
H Acceptors
3
H Donors
1
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: C₁₁H₈BrNO₃
Molecular Weight: 282.09
Synonyms: None
SMILES: BrC1=CC(=C(C=C1)C(O)=O)C2(C#N)COC2
Tpsa: 70.32
Logp: 1.93888
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:
C₁₁H₈BrNO₃
Molecular Weight:
282.09
Synonyms:
None
SMILES:
BrC1=CC(=C(C=C1)C(O)=O)C2(C#N)COC2
Tpsa:
70.32
Logp:
1.93888
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: C₁₃H₉F₄NO₂
Molecular Weight: 287.21
Synonyms: None
SMILES: COC(=O)C1=C(C(F)=C(C=C1)C(F)(F)F)C2(C#N)CC2
Tpsa: 50.09
Logp: 3.18628
H Acceptors: 3
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:
C₁₃H₉F₄NO₂
Molecular Weight:
287.21
Synonyms:
None
SMILES:
COC(=O)C1=C(C(F)=C(C=C1)C(F)(F)F)C2(C#N)CC2
Tpsa:
50.09
Logp:
3.18628
H Acceptors:
3
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: C₁₂H₇F₄NO₂
Molecular Weight: 273.18
Synonyms: None
SMILES: OC(=O)C1=C(C(F)=C(C=C1)C(F)(F)F)C2(C#N)CC2
Tpsa: 61.09
Logp: 3.09788
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:
C₁₂H₇F₄NO₂
Molecular Weight:
273.18
Synonyms:
None
SMILES:
OC(=O)C1=C(C(F)=C(C=C1)C(F)(F)F)C2(C#N)CC2
Tpsa:
61.09
Logp:
3.09788
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: C₁₃H₁₀F₃NO₂
Molecular Weight: 269.22
Synonyms: None
SMILES: COC(=O)C1=C(C=C(C=C1)C(F)(F)F)C2(C#N)CC2
Tpsa: 50.09
Logp: 3.04718
H Acceptors: 3
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:
C₁₃H₁₀F₃NO₂
Molecular Weight:
269.22
Synonyms:
None
SMILES:
COC(=O)C1=C(C=C(C=C1)C(F)(F)F)C2(C#N)CC2
Tpsa:
50.09
Logp:
3.04718
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2