CS-0345374
3-(Allylcarbamoyl)benzoic acid
Manufacturer: ChemScene
CAS Number: 1154950-54-5
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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
C₁₁H₁₁NO₃
Molecular Weight
205.21
Synonyms
None
SMILES
O=C(O)C1=CC=CC(C(NCC=C)=O)=C1
Tpsa
66.4
Logp
1.3006
H Acceptors
2
H Donors
2
Rotatable Bonds
4
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
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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: C₁₁H₁₁NO₃
Molecular Weight: 205.21
Synonyms: None
SMILES: O=C(O)C1=CC=CC(C(NCC=C)=O)=C1
Tpsa: 66.4
Logp: 1.3006
H Acceptors: 2
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:
C₁₁H₁₁NO₃
Molecular Weight:
205.21
Synonyms:
None
SMILES:
O=C(O)C1=CC=CC(C(NCC=C)=O)=C1
Tpsa:
66.4
Logp:
1.3006
H Acceptors:
2
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: C₁₂H₁₄N₂O₄
Molecular Weight: 250.25
Synonyms: None
SMILES: O=C(O)C1=CC=CC(C(NCCNC(C)=O)=O)=C1
Tpsa: 95.5
Logp: 0.2507
H Acceptors: 3
H Donors: 3
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:
C₁₂H₁₄N₂O₄
Molecular Weight:
250.25
Synonyms:
None
SMILES:
O=C(O)C1=CC=CC(C(NCCNC(C)=O)=O)=C1
Tpsa:
95.5
Logp:
0.2507
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
5
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₃NO₄
Molecular Weight: 259.26
Synonyms: 3-methyl-2-(3-methylfuran-2-amido)benzoic acid
SMILES: O=C(O)C1=CC=CC(C)=C1NC(C2=C(C)C=CO2)=O
Tpsa: 79.54
Logp: 2.84694
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₃NO₄
Molecular Weight:
259.26
Synonyms:
3-methyl-2-(3-methylfuran-2-amido)benzoic acid
SMILES:
O=C(O)C1=CC=CC(C)=C1NC(C2=C(C)C=CO2)=O
Tpsa:
79.54
Logp:
2.84694
H Acceptors:
3
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: C₁₂H₁₅NO₃
Molecular Weight: 221.25
Synonyms: None
SMILES: O=C(O)C1=CC=CC(C)=C1NC(CCC)=O
Tpsa: 66.4
Logp: 2.43182
H Acceptors: 2
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:
C₁₂H₁₅NO₃
Molecular Weight:
221.25
Synonyms:
None
SMILES:
O=C(O)C1=CC=CC(C)=C1NC(CCC)=O
Tpsa:
66.4
Logp:
2.43182
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
4