CS-0549531
2-(3-Aminopyrrolidin-1-yl)-1-(3-methoxyphenyl)ethan-1-one
Manufacturer: ChemScene
CAS Number: 1338675-19-6
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₃H₁₈N₂O₂
Molecular Weight
234.29
Synonyms
None
SMILES
COC1=CC=CC(=C1)C(=O)CN2CCC(C2)N
Tpsa
55.56
Logp
0.9109
H Acceptors
4
H Donors
1
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
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₈N₂O₂
Molecular Weight: 234.29
Synonyms: None
SMILES: COC1=CC=CC(=C1)C(=O)CN2CCC(C2)N
Tpsa: 55.56
Logp: 0.9109
H Acceptors: 4
H Donors: 1
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:
C₁₃H₁₈N₂O₂
Molecular Weight:
234.29
Synonyms:
None
SMILES:
COC1=CC=CC(=C1)C(=O)CN2CCC(C2)N
Tpsa:
55.56
Logp:
0.9109
H Acceptors:
4
H Donors:
1
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: C₁₂H₁₁N₃O₂
Molecular Weight: 229.23
Synonyms: None
SMILES: O=C(N1CC(O)C1)C2=NC3=CC=CC=C3N=C2
Tpsa: 66.32
Logp: 0.4465
H Acceptors: 4
H Donors: 1
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:
C₁₂H₁₁N₃O₂
Molecular Weight:
229.23
Synonyms:
None
SMILES:
O=C(N1CC(O)C1)C2=NC3=CC=CC=C3N=C2
Tpsa:
66.32
Logp:
0.4465
H Acceptors:
4
H Donors:
1
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: C₉H₅F₅O₂
Molecular Weight: 240.13
Synonyms: 1-(3,5-difluoro-4-methoxyphenyl)-2,2,2-trifluoroethanone
SMILES: COC1=C(C=C(C=C1F)C(=O)C(F)(F)F)F
Tpsa: 26.3
Logp: 2.7184
H Acceptors: 2
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:
C₉H₅F₅O₂
Molecular Weight:
240.13
Synonyms:
1-(3,5-difluoro-4-methoxyphenyl)-2,2,2-trifluoroethanone
SMILES:
COC1=C(C=C(C=C1F)C(=O)C(F)(F)F)F
Tpsa:
26.3
Logp:
2.7184
H Acceptors:
2
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: C₁₀H₁₃ClN₄O
Molecular Weight: 240.69
Synonyms: None
SMILES: C1CN(CCC1C(=O)N)C2=NC(=NC=C2)Cl
Tpsa: 72.11
Logp: 0.8317
H Acceptors: 4
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:
C₁₀H₁₃ClN₄O
Molecular Weight:
240.69
Synonyms:
None
SMILES:
C1CN(CCC1C(=O)N)C2=NC(=NC=C2)Cl
Tpsa:
72.11
Logp:
0.8317
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2