CS-0805860
tert-Butyl 3-fluoro-4-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
Manufacturer: ChemScene
CAS Number: 911370-56-4
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Purity
98%
MDL No
MFCD22494443
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₈H₂₆BFO₄
Molecular Weight
336.21
Synonyms
None
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2C)F)C(=O)OC(C)(C)C
Tpsa
44.76
Logp
3.38862
H Acceptors
4
H Donors
0
Rotatable Bonds
2
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SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
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Purity: 98%
MDL No: MFCD22494443
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₂₆BFO₄
Molecular Weight: 336.21
Synonyms: None
SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2C)F)C(=O)OC(C)(C)C
Tpsa: 44.76
Logp: 3.38862
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD22494443
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₆BFO₄
Molecular Weight:
336.21
Synonyms:
None
SMILES:
B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2C)F)C(=O)OC(C)(C)C
Tpsa:
44.76
Logp:
3.38862
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD28886121
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₃BrF₃IN₂O₂
Molecular Weight: 410.91
Synonyms: None
SMILES: O=C(N)C1=NC(I)=C(OC(F)(F)F)C(Br)=C1
Tpsa: 65.21
Logp: 2.4462
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD28886121
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₃BrF₃IN₂O₂
Molecular Weight:
410.91
Synonyms:
None
SMILES:
O=C(N)C1=NC(I)=C(OC(F)(F)F)C(Br)=C1
Tpsa:
65.21
Logp:
2.4462
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD25416024
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₈F₂INO
Molecular Weight: 299.06
Synonyms: None
SMILES: CC1=C(N=C(C=C1C(F)F)I)CO
Tpsa: 33.12
Logp: 2.42452
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD25416024
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₈F₂INO
Molecular Weight:
299.06
Synonyms:
None
SMILES:
CC1=C(N=C(C=C1C(F)F)I)CO
Tpsa:
33.12
Logp:
2.42452
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: C₇H₁₁BN₂O₂S
Molecular Weight: 198.05
Synonyms: None
SMILES: B(C1=CSC(=N1)NC2CCC2)(O)O
Tpsa: 65.38
Logp: -0.2127
H Acceptors: 5
H Donors: 3
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:
C₇H₁₁BN₂O₂S
Molecular Weight:
198.05
Synonyms:
None
SMILES:
B(C1=CSC(=N1)NC2CCC2)(O)O
Tpsa:
65.38
Logp:
-0.2127
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
3