CS-0093628
Methyl 4-methyl-5-(2-(trifluoromethyl)phenyl)-1H-pyrrole-3-carboxylate
Manufacturer: ChemScene
CAS Number: 880778-75-6
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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
C₁₄H₁₂F₃NO₂
Molecular Weight
283.25
Synonyms
None
SMILES
O=C(C1=CNC(C2=CC=CC=C2C(F)(F)F)=C1C)OC
Tpsa
42.09
Logp
3.79552
H Acceptors
2
H Donors
1
Rotatable Bonds
2
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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: C₁₄H₁₂F₃NO₂
Molecular Weight: 283.25
Synonyms: None
SMILES: O=C(C1=CNC(C2=CC=CC=C2C(F)(F)F)=C1C)OC
Tpsa: 42.09
Logp: 3.79552
H Acceptors: 2
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:
C₁₄H₁₂F₃NO₂
Molecular Weight:
283.25
Synonyms:
None
SMILES:
O=C(C1=CNC(C2=CC=CC=C2C(F)(F)F)=C1C)OC
Tpsa:
42.09
Logp:
3.79552
H Acceptors:
2
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: C₁₁H₁₉NO₅
Molecular Weight: 245.27
Synonyms: None
SMILES: O=C([C@H]1NCC(O)C[C@@H]1C(OC(C)(C)C)=O)O
Tpsa: 95.86
Logp: -0.2483
H Acceptors: 5
H Donors: 3
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:
C₁₁H₁₉NO₅
Molecular Weight:
245.27
Synonyms:
None
SMILES:
O=C([C@H]1NCC(O)C[C@@H]1C(OC(C)(C)C)=O)O
Tpsa:
95.86
Logp:
-0.2483
H Acceptors:
5
H Donors:
3
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: C₈H₆F₃NOS
Molecular Weight: 221.20
Synonyms: N-trifluoroacetyl-p-mercaptoaniline
SMILES: O=C(NC1=CC=C(S)C=C1)C(F)(F)F
Tpsa: 29.1
Logp: 2.4761
H Acceptors: 2
H Donors: 2
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:
C₈H₆F₃NOS
Molecular Weight:
221.20
Synonyms:
N-trifluoroacetyl-p-mercaptoaniline
SMILES:
O=C(NC1=CC=C(S)C=C1)C(F)(F)F
Tpsa:
29.1
Logp:
2.4761
H Acceptors:
2
H Donors:
2
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: C₂₁H₂₂BrNO₃
Molecular Weight: 416.31
Synonyms: 497224-08-5
SMILES: O=C(/C1=C/C2=CC(Br)=CC=C2N(CC3=CC=C(OC)C=C3)CCC1)OC
Tpsa: 38.77
Logp: 4.8145
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:
C₂₁H₂₂BrNO₃
Molecular Weight:
416.31
Synonyms:
497224-08-5
SMILES:
O=C(/C1=C/C2=CC(Br)=CC=C2N(CC3=CC=C(OC)C=C3)CCC1)OC
Tpsa:
38.77
Logp:
4.8145
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
4