CS-0345329
2-Chloro-4-(pent-4-enamido)benzoic acid
Manufacturer: ChemScene
CAS Number: 1281659-56-0
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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
C₁₂H₁₂ClNO₃
Molecular Weight
253.68
Synonyms
None
SMILES
O=C(O)C1=CC=C(NC(CCC=C)=O)C=C1Cl
Tpsa
66.4
Logp
2.9429
H Acceptors
2
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: C₁₂H₁₂ClNO₃
Molecular Weight: 253.68
Synonyms: None
SMILES: O=C(O)C1=CC=C(NC(CCC=C)=O)C=C1Cl
Tpsa: 66.4
Logp: 2.9429
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:
C₁₂H₁₂ClNO₃
Molecular Weight:
253.68
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(NC(CCC=C)=O)C=C1Cl
Tpsa:
66.4
Logp:
2.9429
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: C₁₂H₁₁N₃O₃
Molecular Weight: 245.23
Synonyms: None
SMILES: O=C(O)C1=CC=C(NC(CN2N=CC=C2)=O)C=C1
Tpsa: 84.22
Logp: 1.22
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:
C₁₂H₁₁N₃O₃
Molecular Weight:
245.23
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(NC(CN2N=CC=C2)=O)C=C1
Tpsa:
84.22
Logp:
1.22
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
4
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₆N₂O₃
Molecular Weight: 236.27
Synonyms: 4-[(Butylcarbamoyl)amino]benzoic acid
SMILES: O=C(O)C1=CC=C(NC(NCCCC)=O)C=C1
Tpsa: 78.43
Logp: 2.3064
H Acceptors: 2
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:
C₁₂H₁₆N₂O₃
Molecular Weight:
236.27
Synonyms:
4-[(Butylcarbamoyl)amino]benzoic acid
SMILES:
O=C(O)C1=CC=C(NC(NCCCC)=O)C=C1
Tpsa:
78.43
Logp:
2.3064
H Acceptors:
2
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: C₁₂H₁₄N₂O₆
Molecular Weight: 282.25
Synonyms: None
SMILES: O=C(O)C1=CC=C(NC(OC(C)(C)C)=O)C([N+]([O-])=O)=C1
Tpsa: 118.77
Logp: 2.64
H Acceptors: 5
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:
C₁₂H₁₄N₂O₆
Molecular Weight:
282.25
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(NC(OC(C)(C)C)=O)C([N+]([O-])=O)=C1
Tpsa:
118.77
Logp:
2.64
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
3