CS-1075638
Tert-butyl 3-((tert-butoxycarbonyl)amino)-4-cyano-1-methyl-1H-pyrrole-2-carboxylate
Manufacturer: ChemScene
CAS Number: 2680816-69-5
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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
C₁₆H₂₃N₃O₄
Molecular Weight
321.37
Synonyms
None
SMILES
N#CC1=CN(C(C(=O)OC(C)(C)C)=C1NC(=O)OC(C)(C)C)C
Tpsa
93.35
Logp
3.19908
H Acceptors
6
H Donors
1
Rotatable Bonds
2
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: C₁₆H₂₃N₃O₄
Molecular Weight: 321.37
Synonyms: None
SMILES: N#CC1=CN(C(C(=O)OC(C)(C)C)=C1NC(=O)OC(C)(C)C)C
Tpsa: 93.35
Logp: 3.19908
H Acceptors: 6
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:
C₁₆H₂₃N₃O₄
Molecular Weight:
321.37
Synonyms:
None
SMILES:
N#CC1=CN(C(C(=O)OC(C)(C)C)=C1NC(=O)OC(C)(C)C)C
Tpsa:
93.35
Logp:
3.19908
H Acceptors:
6
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: C₉H₈N₄O₃
Molecular Weight: 220.18
Synonyms: None
SMILES: O=C(O)C=1C=CC2=NC(=NN2C1)NC(=O)C
Tpsa: 96.59
Logp: 0.3859
H Acceptors: 5
H Donors: 2
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:
C₉H₈N₄O₃
Molecular Weight:
220.18
Synonyms:
None
SMILES:
O=C(O)C=1C=CC2=NC(=NN2C1)NC(=O)C
Tpsa:
96.59
Logp:
0.3859
H Acceptors:
5
H Donors:
2
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: C₁₆H₂₀N₂O₂
Molecular Weight: 272.34
Synonyms: None
SMILES: N#CC1(C=2C=CC=CC2)CC(NC(=O)OC(C)(C)C)C1
Tpsa: 62.12
Logp: 3.13508
H Acceptors: 3
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:
C₁₆H₂₀N₂O₂
Molecular Weight:
272.34
Synonyms:
None
SMILES:
N#CC1(C=2C=CC=CC2)CC(NC(=O)OC(C)(C)C)C1
Tpsa:
62.12
Logp:
3.13508
H Acceptors:
3
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: C₁₆H₂₂N₂O₂
Molecular Weight: 274.36
Synonyms: None
SMILES: O=C(OCC=1C=CC=CC1)N2CCN(CC=C)CCC2
Tpsa: 32.78
Logp: 2.5169
H Acceptors: 3
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:
C₁₆H₂₂N₂O₂
Molecular Weight:
274.36
Synonyms:
None
SMILES:
O=C(OCC=1C=CC=CC1)N2CCN(CC=C)CCC2
Tpsa:
32.78
Logp:
2.5169
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
4