CS-0904804
tert-Butyl 4-bromo-2-(1-(trifluoromethyl)cyclopropyl)-1H-pyrrole-1-carboxylate
Manufacturer: ChemScene
CAS Number: 2996117-12-3
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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
C₁₃H₁₅BrF₃NO₂
Molecular Weight
354.16
Synonyms
None
SMILES
O=C(N1C(C2(C(F)(F)F)CC2)=CC(Br)=C1)OC(C)(C)C
Tpsa
31.23
Logp
4.6277
H Acceptors
3
H Donors
0
Rotatable Bonds
1
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: C₁₃H₁₅BrF₃NO₂
Molecular Weight: 354.16
Synonyms: None
SMILES: O=C(N1C(C2(C(F)(F)F)CC2)=CC(Br)=C1)OC(C)(C)C
Tpsa: 31.23
Logp: 4.6277
H Acceptors: 3
H Donors: 0
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:
C₁₃H₁₅BrF₃NO₂
Molecular Weight:
354.16
Synonyms:
None
SMILES:
O=C(N1C(C2(C(F)(F)F)CC2)=CC(Br)=C1)OC(C)(C)C
Tpsa:
31.23
Logp:
4.6277
H Acceptors:
3
H Donors:
0
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: C₁₀H₈ClN₃O₃
Molecular Weight: 253.64
Synonyms: None
SMILES: O=C1N=CNC2=C(C(OCC)=O)C=C(Cl)N=C21
Tpsa: 84.94
Logp: 1.1482
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:
C₁₀H₈ClN₃O₃
Molecular Weight:
253.64
Synonyms:
None
SMILES:
O=C1N=CNC2=C(C(OCC)=O)C=C(Cl)N=C21
Tpsa:
84.94
Logp:
1.1482
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: C₁₀H₇Cl₂N₃O₂
Molecular Weight: 272.09
Synonyms: None
SMILES: O=C(C1=CC(Cl)=NC2=C1N=CN=C2Cl)OCC
Tpsa: 64.97
Logp: 2.5083
H Acceptors: 5
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:
C₁₀H₇Cl₂N₃O₂
Molecular Weight:
272.09
Synonyms:
None
SMILES:
O=C(C1=CC(Cl)=NC2=C1N=CN=C2Cl)OCC
Tpsa:
64.97
Logp:
2.5083
H Acceptors:
5
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: C₁₀H₇BN₂O₂
Molecular Weight: 197.99
Synonyms: None
SMILES: N#CC1=C(B(O)O)C=CC2=NC=CC=C21
Tpsa: 77.14
Logp: -0.21372
H Acceptors: 4
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:
C₁₀H₇BN₂O₂
Molecular Weight:
197.99
Synonyms:
None
SMILES:
N#CC1=C(B(O)O)C=CC2=NC=CC=C21
Tpsa:
77.14
Logp:
-0.21372
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
1