CS-1063503
3-(((Benzyloxy)carbonyl)amino)-4-cyano-1-ethyl-1H-pyrrole-2-carboxylic acid
Manufacturer: ChemScene
CAS Number: 2580185-39-1
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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
C₁₆H₁₅N₃O₄
Molecular Weight
313.31
Synonyms
None
SMILES
N#CC1=CN(C(C(=O)O)=C1NC(=O)OCC=2C=CC=CC2)CC
Tpsa
104.35
Logp
2.82658
H Acceptors
5
H Donors
2
Rotatable Bonds
5
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: C₁₆H₁₅N₃O₄
Molecular Weight: 313.31
Synonyms: None
SMILES: N#CC1=CN(C(C(=O)O)=C1NC(=O)OCC=2C=CC=CC2)CC
Tpsa: 104.35
Logp: 2.82658
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₅N₃O₄
Molecular Weight:
313.31
Synonyms:
None
SMILES:
N#CC1=CN(C(C(=O)O)=C1NC(=O)OCC=2C=CC=CC2)CC
Tpsa:
104.35
Logp:
2.82658
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₇NO₂
Molecular Weight: 183.25
Synonyms: None
SMILES: O=C(OCC)C1NCCC2(CC2)C1
Tpsa: 38.33
Logp: 1.0817
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:
C₁₀H₁₇NO₂
Molecular Weight:
183.25
Synonyms:
None
SMILES:
O=C(OCC)C1NCCC2(CC2)C1
Tpsa:
38.33
Logp:
1.0817
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: C₈H₁₅NO
Molecular Weight: 141.21
Synonyms: None
SMILES: O1CC2CC1(CN)C2(C)C
Tpsa: 35.25
Logp: 0.7602
H Acceptors: 2
H Donors: 1
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:
C₈H₁₅NO
Molecular Weight:
141.21
Synonyms:
None
SMILES:
O1CC2CC1(CN)C2(C)C
Tpsa:
35.25
Logp:
0.7602
H Acceptors:
2
H Donors:
1
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: C₁₀H₁₇NO₃
Molecular Weight: 199.25
Synonyms: None
SMILES: O=C(OCC)C1NCC2(OC1)CCC2
Tpsa: 47.56
Logp: 0.4606
H Acceptors: 4
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:
C₁₀H₁₇NO₃
Molecular Weight:
199.25
Synonyms:
None
SMILES:
O=C(OCC)C1NCC2(OC1)CCC2
Tpsa:
47.56
Logp:
0.4606
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2