CS-1139591
1-(3,5-Difluorophenyl)-3-methylbutan-2-one
Manufacturer: ChemScene
CAS Number: 1248194-32-2
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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
C₁₁H₁₂F₂O
Molecular Weight
198.21
Synonyms
None
SMILES
O=C(CC=1C=C(F)C=C(F)C1)C(C)C
Tpsa
17.07
Logp
2.7324
H Acceptors
1
H Donors
0
Rotatable Bonds
3
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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: C₁₁H₁₂F₂O
Molecular Weight: 198.21
Synonyms: None
SMILES: O=C(CC=1C=C(F)C=C(F)C1)C(C)C
Tpsa: 17.07
Logp: 2.7324
H Acceptors: 1
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:
C₁₁H₁₂F₂O
Molecular Weight:
198.21
Synonyms:
None
SMILES:
O=C(CC=1C=C(F)C=C(F)C1)C(C)C
Tpsa:
17.07
Logp:
2.7324
H Acceptors:
1
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: C₁₂H₁₆N₂O₂
Molecular Weight: 220.27
Synonyms: None
SMILES: C(C=1C=C2C(=CC1)OCO2)[C@@H]3CNCCN3
Tpsa: 42.52
Logp: 0.5192
H Acceptors: 4
H Donors: 2
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:
C₁₂H₁₆N₂O₂
Molecular Weight:
220.27
Synonyms:
None
SMILES:
C(C=1C=C2C(=CC1)OCO2)[C@@H]3CNCCN3
Tpsa:
42.52
Logp:
0.5192
H Acceptors:
4
H Donors:
2
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: C₉H₈INO₂
Molecular Weight: 289.07
Synonyms: None
SMILES: O=CC1=CC(I)=NC=C1OC2CC2
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:
C₉H₈INO₂
Molecular Weight:
289.07
Synonyms:
None
SMILES:
O=CC1=CC(I)=NC=C1OC2CC2
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: C₁₁H₁₂O₃S
Molecular Weight: 224.27
Synonyms: None
SMILES: O=C(O)C1=CC=C(SC)C(OC2CC2)=C1
Tpsa: 46.53
Logp: 2.6479
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₂O₃S
Molecular Weight:
224.27
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(SC)C(OC2CC2)=C1
Tpsa:
46.53
Logp:
2.6479
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
4