CS-0881265
4-Cyano-1,3-dimethyl-1H-pyrrole-2-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1553133-78-0
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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
C₈H₈N₂O₂
Molecular Weight
164.16
Synonyms
None
SMILES
O=C(C1=C(C)C(C#N)=CN1C)O
Tpsa
66.02
Logp
0.9034
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: C₈H₈N₂O₂
Molecular Weight: 164.16
Synonyms: None
SMILES: O=C(C1=C(C)C(C#N)=CN1C)O
Tpsa: 66.02
Logp: 0.9034
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:
C₈H₈N₂O₂
Molecular Weight:
164.16
Synonyms:
None
SMILES:
O=C(C1=C(C)C(C#N)=CN1C)O
Tpsa:
66.02
Logp:
0.9034
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: C₁₄H₂₅NO₃Si
Molecular Weight: 283.44
Synonyms: None
SMILES: O=C(N1CC(C#C[Si](C)(C)C)(O)CC1)OC(C)(C)C
Tpsa: 49.77
Logp: 2.2391
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₅NO₃Si
Molecular Weight:
283.44
Synonyms:
None
SMILES:
O=C(N1CC(C#C[Si](C)(C)C)(O)CC1)OC(C)(C)C
Tpsa:
49.77
Logp:
2.2391
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₁NO₂
Molecular Weight: 177.20
Synonyms: None
SMILES: O=C(C1=NC=C(C=C)C=C1C)OC
Tpsa: 39.19
Logp: 1.81962
H Acceptors: 3
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:
C₁₀H₁₁NO₂
Molecular Weight:
177.20
Synonyms:
None
SMILES:
O=C(C1=NC=C(C=C)C=C1C)OC
Tpsa:
39.19
Logp:
1.81962
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₆F₃NO
Molecular Weight: 259.27
Synonyms: None
SMILES: OCC1(C(F)(F)F)CN(CC2=CC=CC=C2)CC1
Tpsa: 23.47
Logp: 2.4333
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₆F₃NO
Molecular Weight:
259.27
Synonyms:
None
SMILES:
OCC1(C(F)(F)F)CN(CC2=CC=CC=C2)CC1
Tpsa:
23.47
Logp:
2.4333
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3