CS-1161733
2-Methyl-3-phenyl-2,3-dihydroisoxazole-5-carbonitrile
Manufacturer: ChemScene
CAS Number: 87352-12-3
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Purity
97%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₁H₁₀N₂O
Molecular Weight
186.21
Synonyms
None
SMILES
N#CC=1ON(C)C(C1)C=2C=CC=CC2
Tpsa
36.26
Logp
2.01218
H Acceptors
3
H Donors
0
Rotatable Bonds
1
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: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₀N₂O
Molecular Weight: 186.21
Synonyms: None
SMILES: N#CC=1ON(C)C(C1)C=2C=CC=CC2
Tpsa: 36.26
Logp: 2.01218
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₀N₂O
Molecular Weight:
186.21
Synonyms:
None
SMILES:
N#CC=1ON(C)C(C1)C=2C=CC=CC2
Tpsa:
36.26
Logp:
2.01218
H Acceptors:
3
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: C₁₄H₁₂ClN₃O₂
Molecular Weight: 289.72
Synonyms: None
SMILES: O=C(N1N=C(C(C=2ON=C3C=CC(Cl)=CC32)=C1C)C)C
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:
C₁₄H₁₂ClN₃O₂
Molecular Weight:
289.72
Synonyms:
None
SMILES:
O=C(N1N=C(C(C=2ON=C3C=CC(Cl)=CC32)=C1C)C)C
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: C₅H₆FNO₃
Molecular Weight: 147.11
Synonyms: None
SMILES: O=C(O)C1NC(=O)C(F)C1
Tpsa: 66.4
Logp: -0.7024
H Acceptors: 2
H Donors: 2
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:
C₅H₆FNO₃
Molecular Weight:
147.11
Synonyms:
None
SMILES:
O=C(O)C1NC(=O)C(F)C1
Tpsa:
66.4
Logp:
-0.7024
H Acceptors:
2
H Donors:
2
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: C₉H₈F₂O₂
Molecular Weight: 186.16
Synonyms: None
SMILES: [C@H](C(O)=O)(C)C1=C(F)C=C(F)C=C1
Tpsa: 37.3
Logp: 2.1529
H Acceptors: 1
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:
C₉H₈F₂O₂
Molecular Weight:
186.16
Synonyms:
None
SMILES:
[C@H](C(O)=O)(C)C1=C(F)C=C(F)C=C1
Tpsa:
37.3
Logp:
2.1529
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
2