CS-1168396
1-(Pyrimidin-5-yl)butan-1-one
Manufacturer: ChemScene
CAS Number: 53342-26-0
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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
C₈H₁₀N₂O
Molecular Weight
150.18
Synonyms
None
SMILES
O=C(C=1C=NC=NC1)CCC
Tpsa
42.85
Logp
1.4594
H Acceptors
3
H Donors
0
Rotatable Bonds
3
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: C₈H₁₀N₂O
Molecular Weight: 150.18
Synonyms: None
SMILES: O=C(C=1C=NC=NC1)CCC
Tpsa: 42.85
Logp: 1.4594
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:
C₈H₁₀N₂O
Molecular Weight:
150.18
Synonyms:
None
SMILES:
O=C(C=1C=NC=NC1)CCC
Tpsa:
42.85
Logp:
1.4594
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: C₉H₉FO₂
Molecular Weight: 168.17
Synonyms: None
SMILES: O=C(O)C1=CC(F)=C(C=C1C)C
Tpsa: 37.3
Logp: 2.14074
H Acceptors: 1
H Donors: 1
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:
C₉H₉FO₂
Molecular Weight:
168.17
Synonyms:
None
SMILES:
O=C(O)C1=CC(F)=C(C=C1C)C
Tpsa:
37.3
Logp:
2.14074
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
1
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₅NO₃
Molecular Weight: 209.25
Synonyms: None
SMILES: C(NC(/C=C\C(O)=O)=O)(CC)(CC)C#C
Tpsa: 66.4
Logp: 0.9354
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 5
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₅NO₃
Molecular Weight:
209.25
Synonyms:
None
SMILES:
C(NC(/C=C\C(O)=O)=O)(CC)(CC)C#C
Tpsa:
66.4
Logp:
0.9354
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₉F₂IN₂
Molecular Weight: 346.12
Synonyms: None
SMILES: FC=1C=CC(=C(F)C1)C=2N=C3N(C2I)CCC3
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₉F₂IN₂
Molecular Weight:
346.12
Synonyms:
None
SMILES:
FC=1C=CC(=C(F)C1)C=2N=C3N(C2I)CCC3
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A