CS-1150655
5-Cyano-2-(furan-3-carboxamido)benzoic acid
Manufacturer: ChemScene
CAS Number: 668976-01-0
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Purity
97%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₃H₈N₂O₄
Molecular Weight
256.22
Synonyms
None
SMILES
N#CC1=CC=C(NC(=O)C2=COC=C2)C(=C1)C(=O)O
Tpsa
103.33
Logp
2.10178
H Acceptors
4
H Donors
2
Rotatable Bonds
3
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: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₈N₂O₄
Molecular Weight: 256.22
Synonyms: None
SMILES: N#CC1=CC=C(NC(=O)C2=COC=C2)C(=C1)C(=O)O
Tpsa: 103.33
Logp: 2.10178
H Acceptors: 4
H Donors: 2
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:
C₁₃H₈N₂O₄
Molecular Weight:
256.22
Synonyms:
None
SMILES:
N#CC1=CC=C(NC(=O)C2=COC=C2)C(=C1)C(=O)O
Tpsa:
103.33
Logp:
2.10178
H Acceptors:
4
H Donors:
2
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: C₁₀H₁₀N₂O₅
Molecular Weight: 238.20
Synonyms: None
SMILES: [C@@H](NC(C)=O)(C(O)=O)C1=CC=C(N(=O)=O)C=C1
Tpsa: 109.54
Logp: 0.8566
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:
C₁₀H₁₀N₂O₅
Molecular Weight:
238.20
Synonyms:
None
SMILES:
[C@@H](NC(C)=O)(C(O)=O)C1=CC=C(N(=O)=O)C=C1
Tpsa:
109.54
Logp:
0.8566
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
4
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₇ClN₄O
Molecular Weight: 244.72
Synonyms: None
SMILES: ClC=1N=C(N=C(C1)NCCO)N(CC)CC
Tpsa: 61.28
Logp: 1.3804
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 6
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₇ClN₄O
Molecular Weight:
244.72
Synonyms:
None
SMILES:
ClC=1N=C(N=C(C1)NCCO)N(CC)CC
Tpsa:
61.28
Logp:
1.3804
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
6
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₈F₃NO
Molecular Weight: 191.15
Synonyms: None
SMILES: O=C(C1=CC=C(N1C)C)C(F)(F)F
Tpsa: 22
Logp: 2.07852
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₈F₃NO
Molecular Weight:
191.15
Synonyms:
None
SMILES:
O=C(C1=CC=C(N1C)C)C(F)(F)F
Tpsa:
22
Logp:
2.07852
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1