CS-0347258
Methyl 3-(cyclopropanecarboxamido)-4-fluorobenzoate
Manufacturer: ChemScene
CAS Number: 1090436-81-9
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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
C₁₂H₁₂FNO₃
Molecular Weight
237.23
Synonyms
Benzoic acid, 3-[(cyclopropylcarbonyl)amino]-4-fluoro-, methyl ester
SMILES
O=C(OC)C1=CC=C(F)C(NC(C2CC2)=O)=C1
Tpsa
55.4
Logp
1.9608
H Acceptors
3
H Donors
1
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₂FNO₃
Molecular Weight: 237.23
Synonyms: Benzoic acid, 3-[(cyclopropylcarbonyl)amino]-4-fluoro-, methyl ester
SMILES: O=C(OC)C1=CC=C(F)C(NC(C2CC2)=O)=C1
Tpsa: 55.4
Logp: 1.9608
H Acceptors: 3
H Donors: 1
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:
C₁₂H₁₂FNO₃
Molecular Weight:
237.23
Synonyms:
Benzoic acid, 3-[(cyclopropylcarbonyl)amino]-4-fluoro-, methyl ester
SMILES:
O=C(OC)C1=CC=C(F)C(NC(C2CC2)=O)=C1
Tpsa:
55.4
Logp:
1.9608
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₈FNO₄S
Molecular Weight: 233.22
Synonyms: None
SMILES: O=C(OC)C1=CC=C(F)C(S(=O)(N)=O)=C1
Tpsa: 86.46
Logp: 0.2597
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₈FNO₄S
Molecular Weight:
233.22
Synonyms:
None
SMILES:
O=C(OC)C1=CC=C(F)C(S(=O)(N)=O)=C1
Tpsa:
86.46
Logp:
0.2597
H Acceptors:
4
H Donors:
1
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: C₁₀H₁₂ClNO₄S
Molecular Weight: 277.72
Synonyms: Benzoic acid, 3-(chlorosulfonyl)-4-(dimethylamino)-, methyl ester
SMILES: O=C(OC)C1=CC=C(N(C)C)C(S(=O)(Cl)=O)=C1
Tpsa: 63.68
Logp: 1.4667
H Acceptors: 5
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:
C₁₀H₁₂ClNO₄S
Molecular Weight:
277.72
Synonyms:
Benzoic acid, 3-(chlorosulfonyl)-4-(dimethylamino)-, methyl ester
SMILES:
O=C(OC)C1=CC=C(N(C)C)C(S(=O)(Cl)=O)=C1
Tpsa:
63.68
Logp:
1.4667
H Acceptors:
5
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: C₁₀H₁₄N₂O₄S
Molecular Weight: 258.29
Synonyms: Benzoic acid, 3-(aminosulfonyl)-4-(dimethylamino)-, methyl ester
SMILES: O=C(OC)C1=CC=C(N(C)C)C(S(=O)(N)=O)=C1
Tpsa: 89.7
Logp: 0.1866
H Acceptors: 5
H Donors: 1
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:
C₁₀H₁₄N₂O₄S
Molecular Weight:
258.29
Synonyms:
Benzoic acid, 3-(aminosulfonyl)-4-(dimethylamino)-, methyl ester
SMILES:
O=C(OC)C1=CC=C(N(C)C)C(S(=O)(N)=O)=C1
Tpsa:
89.7
Logp:
0.1866
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
3