CS-1144219
1-(3-Ethylbenzo[c]isoxazol-6-yl)ethan-1-one
Manufacturer: ChemScene
CAS Number: 57778-45-7
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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
C₁₁H₁₁NO₂
Molecular Weight
189.21
Synonyms
None
SMILES
O=C(C=1C=CC=2C(=NOC2CC)C1)C
Tpsa
43.1
Logp
2.5928
H Acceptors
3
H Donors
0
Rotatable Bonds
2
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: C₁₁H₁₁NO₂
Molecular Weight: 189.21
Synonyms: None
SMILES: O=C(C=1C=CC=2C(=NOC2CC)C1)C
Tpsa: 43.1
Logp: 2.5928
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 2
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₁NO₂
Molecular Weight:
189.21
Synonyms:
None
SMILES:
O=C(C=1C=CC=2C(=NOC2CC)C1)C
Tpsa:
43.1
Logp:
2.5928
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₁N₃O₂
Molecular Weight: 241.25
Synonyms: None
SMILES: O=C1C=C(NC2=C(C=3C=CC=CC3)C(=O)NN12)C
Tpsa: 70.13
Logp: 1.29132
H Acceptors: 3
H Donors: 2
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:
C₁₃H₁₁N₃O₂
Molecular Weight:
241.25
Synonyms:
None
SMILES:
O=C1C=C(NC2=C(C=3C=CC=CC3)C(=O)NN12)C
Tpsa:
70.13
Logp:
1.29132
H Acceptors:
3
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: C₁₁H₁₂N₂O₂S
Molecular Weight: 236.29
Synonyms: None
SMILES: O=C(O)C1=CC(=NN1C(C)C)C=2SC=CC2
Tpsa: 55.12
Logp: 2.8907
H Acceptors: 4
H Donors: 1
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:
C₁₁H₁₂N₂O₂S
Molecular Weight:
236.29
Synonyms:
None
SMILES:
O=C(O)C1=CC(=NN1C(C)C)C=2SC=CC2
Tpsa:
55.12
Logp:
2.8907
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₇Cl₂N₅
Molecular Weight: 256.09
Synonyms: None
SMILES: ClC1=CC=C(NC=2N=CN=C(N2)N)C(Cl)=C1
Tpsa: 76.72
Logp: 2.5042
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 2
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₇Cl₂N₅
Molecular Weight:
256.09
Synonyms:
None
SMILES:
ClC1=CC=C(NC=2N=CN=C(N2)N)C(Cl)=C1
Tpsa:
76.72
Logp:
2.5042
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
2