CS-0526712
1-(6-(tert-Butyl)-5-fluoropyridin-3-yl)ethanone
Manufacturer: ChemScene
CAS Number: 2230985-76-7
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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
C₁₁H₁₄FNO
Molecular Weight
195.23
Synonyms
None
SMILES
CC(C1=CC(F)=C(C(C)(C)C)N=C1)=O
Tpsa
29.96
Logp
2.7208
H Acceptors
2
H Donors
0
Rotatable Bonds
1
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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
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: C₁₁H₁₄FNO
Molecular Weight: 195.23
Synonyms: None
SMILES: CC(C1=CC(F)=C(C(C)(C)C)N=C1)=O
Tpsa: 29.96
Logp: 2.7208
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₄FNO
Molecular Weight:
195.23
Synonyms:
None
SMILES:
CC(C1=CC(F)=C(C(C)(C)C)N=C1)=O
Tpsa:
29.96
Logp:
2.7208
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD16660461
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₉ClN₂O₄
Molecular Weight: 232.62
Synonyms: 4-Pyrimidinecarboxylic acid, 2-chloro-5,6-dimethoxy-, methyl ester
SMILES: O=C(C1=NC(Cl)=NC(OC)=C1OC)OC
Tpsa: 70.54
Logp: 0.9338
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD16660461
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₉ClN₂O₄
Molecular Weight:
232.62
Synonyms:
4-Pyrimidinecarboxylic acid, 2-chloro-5,6-dimethoxy-, methyl ester
SMILES:
O=C(C1=NC(Cl)=NC(OC)=C1OC)OC
Tpsa:
70.54
Logp:
0.9338
H Acceptors:
6
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: C₅H₉NO₃
Molecular Weight: 131.13
Synonyms: None
SMILES: OC([C@H]1CC(CN1)O)=O
Tpsa: 69.56
Logp: -1.2062
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₉NO₃
Molecular Weight:
131.13
Synonyms:
None
SMILES:
OC([C@H]1CC(CN1)O)=O
Tpsa:
69.56
Logp:
-1.2062
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₇NO₂
Molecular Weight: 207.27
Synonyms: None
SMILES: COC([C@H](C)[C@@H](C1=C(C=CC=N1)C)C)=O
Tpsa: 39.19
Logp: 2.30262
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:
C₁₂H₁₇NO₂
Molecular Weight:
207.27
Synonyms:
None
SMILES:
COC([C@H](C)[C@@H](C1=C(C=CC=N1)C)C)=O
Tpsa:
39.19
Logp:
2.30262
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3