CS-1152132
Ethyl 4-(cyanomethyl)-2-ethoxybenzoate
Manufacturer: ChemScene
CAS Number: 99470-01-6
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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
C₁₃H₁₅NO₃
Molecular Weight
233.27
Synonyms
None
SMILES
N#CCC1=CC=C(C(=O)OCC)C(OCC)=C1
Tpsa
59.32
Logp
2.32808
H Acceptors
4
H Donors
0
Rotatable Bonds
5
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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
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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: C₁₃H₁₅NO₃
Molecular Weight: 233.27
Synonyms: None
SMILES: N#CCC1=CC=C(C(=O)OCC)C(OCC)=C1
Tpsa: 59.32
Logp: 2.32808
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 5
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₅NO₃
Molecular Weight:
233.27
Synonyms:
None
SMILES:
N#CCC1=CC=C(C(=O)OCC)C(OCC)=C1
Tpsa:
59.32
Logp:
2.32808
H Acceptors:
4
H Donors:
0
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: C₁₁H₁₅N₃
Molecular Weight: 189.26
Synonyms: None
SMILES: N(N)=C1NC(C)(C)CC=2C=CC=CC12
Tpsa: 50.41
Logp: 1.2312
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 0
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₅N₃
Molecular Weight:
189.26
Synonyms:
None
SMILES:
N(N)=C1NC(C)(C)CC=2C=CC=CC12
Tpsa:
50.41
Logp:
1.2312
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₅NO
Molecular Weight: 165.24
Synonyms: None
SMILES: O=C(C=1C=CN(C1)C(C)(C)C)C
Tpsa: 22
Logp: 2.4457
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:
C₁₀H₁₅NO
Molecular Weight:
165.24
Synonyms:
None
SMILES:
O=C(C=1C=CN(C1)C(C)(C)C)C
Tpsa:
22
Logp:
2.4457
H Acceptors:
2
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: C₈H₅ClN₂S
Molecular Weight: 196.65
Synonyms: None
SMILES: ClC=1C=CC=C2C(S)=CN=NC12
Tpsa: 25.78
Logp: 2.5719
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₅ClN₂S
Molecular Weight:
196.65
Synonyms:
None
SMILES:
ClC=1C=CC=C2C(S)=CN=NC12
Tpsa:
25.78
Logp:
2.5719
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0