CS-0563850
4-((3,4-Dihydro-2H-pyrrol-5-yl)amino)benzonitrile
Manufacturer: ChemScene
CAS Number: 745027-63-8
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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
C₁₁H₁₁N₃
Molecular Weight
185.23
Synonyms
None
SMILES
N#CC1=CC=C(C=C1)NC2=NCCC2
Tpsa
48.18
Logp
2.16248
H Acceptors
3
H Donors
1
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: C₁₁H₁₁N₃
Molecular Weight: 185.23
Synonyms: None
SMILES: N#CC1=CC=C(C=C1)NC2=NCCC2
Tpsa: 48.18
Logp: 2.16248
H Acceptors: 3
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:
C₁₁H₁₁N₃
Molecular Weight:
185.23
Synonyms:
None
SMILES:
N#CC1=CC=C(C=C1)NC2=NCCC2
Tpsa:
48.18
Logp:
2.16248
H Acceptors:
3
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: C₁₀H₁₈N₂O₂
Molecular Weight: 198.26
Synonyms: None
SMILES: CCOC(N1C=NC(=C1C)C)OCC
Tpsa: 36.28
Logp: 2.02904
H Acceptors: 4
H Donors: 0
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:
C₁₀H₁₈N₂O₂
Molecular Weight:
198.26
Synonyms:
None
SMILES:
CCOC(N1C=NC(=C1C)C)OCC
Tpsa:
36.28
Logp:
2.02904
H Acceptors:
4
H Donors:
0
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: C₁₆H₁₄N₂O₄
Molecular Weight: 298.29
Synonyms: Pyrano[2,3-c]pyrazole-5-carboxylic acid, 1,6-dihydro-3-methyl-6-oxo-1-phenyl-, ethyl ester
SMILES: CCOC(=O)C1=CC2=C(N(N=C2C)C3=CC=CC=C3)OC1=O
Tpsa: 74.33
Logp: 2.46382
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₄N₂O₄
Molecular Weight:
298.29
Synonyms:
Pyrano[2,3-c]pyrazole-5-carboxylic acid, 1,6-dihydro-3-methyl-6-oxo-1-phenyl-, ethyl ester
SMILES:
CCOC(=O)C1=CC2=C(N(N=C2C)C3=CC=CC=C3)OC1=O
Tpsa:
74.33
Logp:
2.46382
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₅NO₃
Molecular Weight: 221.25
Synonyms: None
SMILES: C(CC(N[C@H](C(O)=O)C)=O)C1=CC=CC=C1
Tpsa: 66.4
Logp: 1.2085
H Acceptors: 2
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:
C₁₂H₁₅NO₃
Molecular Weight:
221.25
Synonyms:
None
SMILES:
C(CC(N[C@H](C(O)=O)C)=O)C1=CC=CC=C1
Tpsa:
66.4
Logp:
1.2085
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
5