CS-1057945
Benzyl 4-((tert-butoxycarbonyl)amino)-1H-pyrrole-2-carboxylate
Manufacturer: ChemScene
CAS Number: 85406-55-9
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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
C₁₇H₂₀N₂O₄
Molecular Weight
316.35
Synonyms
None
SMILES
O=C(OC(C)(C)C)NC1=CNC(=C1)C(=O)OCC=2C=CC=CC2
Tpsa
80.42
Logp
3.7187
H Acceptors
4
H Donors
2
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: C₁₇H₂₀N₂O₄
Molecular Weight: 316.35
Synonyms: None
SMILES: O=C(OC(C)(C)C)NC1=CNC(=C1)C(=O)OCC=2C=CC=CC2
Tpsa: 80.42
Logp: 3.7187
H Acceptors: 4
H Donors: 2
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:
C₁₇H₂₀N₂O₄
Molecular Weight:
316.35
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)NC1=CNC(=C1)C(=O)OCC=2C=CC=CC2
Tpsa:
80.42
Logp:
3.7187
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
4
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₂FN
Molecular Weight: 249.28
Synonyms: None
SMILES: FC1=CC=CC(C=NC=2C=CC=3C=CC=CC3C2)=C1
Tpsa: 12.36
Logp: 4.7295
H Acceptors: 1
H Donors: 0
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:
C₁₇H₁₂FN
Molecular Weight:
249.28
Synonyms:
None
SMILES:
FC1=CC=CC(C=NC=2C=CC=3C=CC=CC3C2)=C1
Tpsa:
12.36
Logp:
4.7295
H Acceptors:
1
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: C₁₃H₁₄ClN
Molecular Weight: 219.71
Synonyms: None
SMILES: ClC=1N=C2C=CC=CC2=CC1C(C)CC
Tpsa: 12.89
Logp: 4.4017
H Acceptors: 1
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:
C₁₃H₁₄ClN
Molecular Weight:
219.71
Synonyms:
None
SMILES:
ClC=1N=C2C=CC=CC2=CC1C(C)CC
Tpsa:
12.89
Logp:
4.4017
H Acceptors:
1
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: C₁₂H₁₂ClN
Molecular Weight: 205.68
Synonyms: None
SMILES: ClC=1N=C2C=CC=CC2=CC1CCC
Tpsa: 12.89
Logp: 3.8407
H Acceptors: 1
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:
C₁₂H₁₂ClN
Molecular Weight:
205.68
Synonyms:
None
SMILES:
ClC=1N=C2C=CC=CC2=CC1CCC
Tpsa:
12.89
Logp:
3.8407
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
2