CS-0529105
Ethyl 1-benzyl-3-oxoazepane-4-carboxylate
Manufacturer: ChemScene
CAS Number: 478841-09-7
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₆H₂₁NO₃
Molecular Weight
275.34
Synonyms
None
SMILES
O=C(C1C(CN(CC2=CC=CC=C2)CCC1)=O)OCC
Tpsa
46.61
Logp
2.0308
H Acceptors
4
H Donors
0
Rotatable Bonds
4
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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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₂₁NO₃
Molecular Weight: 275.34
Synonyms: None
SMILES: O=C(C1C(CN(CC2=CC=CC=C2)CCC1)=O)OCC
Tpsa: 46.61
Logp: 2.0308
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 4
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₁NO₃
Molecular Weight:
275.34
Synonyms:
None
SMILES:
O=C(C1C(CN(CC2=CC=CC=C2)CCC1)=O)OCC
Tpsa:
46.61
Logp:
2.0308
H Acceptors:
4
H Donors:
0
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: C₁₁H₁₄ClN₃O₂
Molecular Weight: 255.70
Synonyms: None
SMILES: O=C(C1=NC(Cl)=C(N2CCNCC2)C=C1)OC
Tpsa: 54.46
Logp: 0.9312
H Acceptors: 5
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:
C₁₁H₁₄ClN₃O₂
Molecular Weight:
255.70
Synonyms:
None
SMILES:
O=C(C1=NC(Cl)=C(N2CCNCC2)C=C1)OC
Tpsa:
54.46
Logp:
0.9312
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₁ClFNO₂
Molecular Weight: 231.65
Synonyms: None
SMILES: O=C(C1=NC(Cl)=C(F)C=C1)OC(C)(C)C
Tpsa: 39.19
Logp: 2.8294
H Acceptors: 3
H Donors: 0
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:
C₁₀H₁₁ClFNO₂
Molecular Weight:
231.65
Synonyms:
None
SMILES:
O=C(C1=NC(Cl)=C(F)C=C1)OC(C)(C)C
Tpsa:
39.19
Logp:
2.8294
H Acceptors:
3
H Donors:
0
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: C₆H₅ClFNO
Molecular Weight: 161.56
Synonyms: None
SMILES: OCC1=NC(Cl)=C(F)C=C1
Tpsa: 33.12
Logp: 1.3664
H Acceptors: 2
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:
C₆H₅ClFNO
Molecular Weight:
161.56
Synonyms:
None
SMILES:
OCC1=NC(Cl)=C(F)C=C1
Tpsa:
33.12
Logp:
1.3664
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1