CS-1168330
Methyl 4-(4-((methylamino)methyl)phenyl)-4-oxobutanoate
Manufacturer: ChemScene
CAS Number: 697805-21-3
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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
C₁₃H₁₇NO₃
Molecular Weight
235.28
Synonyms
None
SMILES
O=C(OC)CCC(=O)C1=CC=C(C=C1)CNC
Tpsa
55.4
Logp
1.5419
H Acceptors
4
H Donors
1
Rotatable Bonds
6
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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₇NO₃
Molecular Weight: 235.28
Synonyms: None
SMILES: O=C(OC)CCC(=O)C1=CC=C(C=C1)CNC
Tpsa: 55.4
Logp: 1.5419
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 6
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₇NO₃
Molecular Weight:
235.28
Synonyms:
None
SMILES:
O=C(OC)CCC(=O)C1=CC=C(C=C1)CNC
Tpsa:
55.4
Logp:
1.5419
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
6
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₂N₆
Molecular Weight: 252.28
Synonyms: None
SMILES: N#CC1=C(N=C(C(C#N)=C1CC#N)N2CCCC2)N
Tpsa: 113.52
Logp: 1.07344
H Acceptors: 6
H Donors: 1
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:
C₁₃H₁₂N₆
Molecular Weight:
252.28
Synonyms:
None
SMILES:
N#CC1=C(N=C(C(C#N)=C1CC#N)N2CCCC2)N
Tpsa:
113.52
Logp:
1.07344
H Acceptors:
6
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: C₈H₁₃N₃
Molecular Weight: 151.21
Synonyms: None
SMILES: N#CCC1N=CN(C1)C(C)C
Tpsa: 39.39
Logp: 1.02098
H Acceptors: 3
H Donors: 0
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:
C₈H₁₃N₃
Molecular Weight:
151.21
Synonyms:
None
SMILES:
N#CCC1N=CN(C1)C(C)C
Tpsa:
39.39
Logp:
1.02098
H Acceptors:
3
H Donors:
0
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: C₁₃H₁₆F₂O₂
Molecular Weight: 242.27
Synonyms: None
SMILES: O=C(O)C12CC(C1)(C2)C34CC(C3)(C4)C(F)(F)C
Tpsa: 37.3
Logp: 3.0668
H Acceptors: 1
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:
C₁₃H₁₆F₂O₂
Molecular Weight:
242.27
Synonyms:
None
SMILES:
O=C(O)C12CC(C1)(C2)C34CC(C3)(C4)C(F)(F)C
Tpsa:
37.3
Logp:
3.0668
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
3