CS-0116632
3-Methoxy-4-{[4-(trifluoromethyl)benzyl]amino}cyclobut-3-ene-1,2-dione
Manufacturer: ChemScene
CAS Number: 1411983-36-2
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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
C₁₃H₁₀F₃NO₃
Molecular Weight
285.22
Synonyms
None
SMILES
O=C1C(C(OC)=C1NCC2=CC=C(C(F)(F)F)C=C2)=O
Tpsa
55.4
Logp
1.9221
H Acceptors
4
H Donors
1
Rotatable Bonds
4
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: C₁₃H₁₀F₃NO₃
Molecular Weight: 285.22
Synonyms: None
SMILES: O=C1C(C(OC)=C1NCC2=CC=C(C(F)(F)F)C=C2)=O
Tpsa: 55.4
Logp: 1.9221
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:
C₁₃H₁₀F₃NO₃
Molecular Weight:
285.22
Synonyms:
None
SMILES:
O=C1C(C(OC)=C1NCC2=CC=C(C(F)(F)F)C=C2)=O
Tpsa:
55.4
Logp:
1.9221
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
4
Purity: 97%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₆ClNO₂
Molecular Weight: 195.60
Synonyms: None
SMILES: O=C1NC2=C(C=CC(Cl)=C2C)C1=O
Tpsa: 46.17
Logp: 1.78322
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₆ClNO₂
Molecular Weight:
195.60
Synonyms:
None
SMILES:
O=C1NC2=C(C=CC(Cl)=C2C)C1=O
Tpsa:
46.17
Logp:
1.78322
H Acceptors:
2
H Donors:
1
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: C₁₂H₁₃NO₂
Molecular Weight: 203.24
Synonyms: None
SMILES: O=C1N(CCCC)C2=C(C=CC=C2)C1=O
Tpsa: 37.38
Logp: 2.016
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 3
Purity:
95+%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₃NO₂
Molecular Weight:
203.24
Synonyms:
None
SMILES:
O=C1N(CCCC)C2=C(C=CC=C2)C1=O
Tpsa:
37.38
Logp:
2.016
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₉ClO₂
Molecular Weight: 184.62
Synonyms: 3-Chloromethyl-4-methoxybenzaldehyde
SMILES: O=CC1=CC=C(OC)C(CCl)=C1
Tpsa: 26.3
Logp: 2.2465
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₉ClO₂
Molecular Weight:
184.62
Synonyms:
3-Chloromethyl-4-methoxybenzaldehyde
SMILES:
O=CC1=CC=C(OC)C(CCl)=C1
Tpsa:
26.3
Logp:
2.2465
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
3