CS-0565621
Methyl 3-chloro-4-fluoro-5-hydroxybenzoate
Manufacturer: ChemScene
CAS Number: 2092777-40-5
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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
C₈H₆ClFO₃
Molecular Weight
204.58
Synonyms
None
SMILES
O=C(C1=CC(Cl)=C(C(O)=C1)F)OC
Tpsa
46.53
Logp
1.9713
H Acceptors
3
H Donors
1
Rotatable Bonds
1
SAFETY INFORMATION
Pictograms
Signal Word
Danger
UN Number
2811
Class
6.1
Packing Group
Ⅲ
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-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: C₈H₆ClFO₃
Molecular Weight: 204.58
Synonyms: None
SMILES: O=C(C1=CC(Cl)=C(C(O)=C1)F)OC
Tpsa: 46.53
Logp: 1.9713
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:
C₈H₆ClFO₃
Molecular Weight:
204.58
Synonyms:
None
SMILES:
O=C(C1=CC(Cl)=C(C(O)=C1)F)OC
Tpsa:
46.53
Logp:
1.9713
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₄O₃
Molecular Weight: 194.23
Synonyms: 2-tert-BUTOXYBENZOIC ACID
SMILES: O=C(O)C1=CC=CC=C1OC(C)(C)C
Tpsa: 46.53
Logp: 2.5621
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₄O₃
Molecular Weight:
194.23
Synonyms:
2-tert-BUTOXYBENZOIC ACID
SMILES:
O=C(O)C1=CC=CC=C1OC(C)(C)C
Tpsa:
46.53
Logp:
2.5621
H Acceptors:
2
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: C₉H₉N₃O₂
Molecular Weight: 191.19
Synonyms: None
SMILES: O=C(C1=CC2=NC(N)=CN2C=C1)OC
Tpsa: 69.62
Logp: 0.7031
H Acceptors: 5
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:
C₉H₉N₃O₂
Molecular Weight:
191.19
Synonyms:
None
SMILES:
O=C(C1=CC2=NC(N)=CN2C=C1)OC
Tpsa:
69.62
Logp:
0.7031
H Acceptors:
5
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: C₁₀H₁₂O₃
Molecular Weight: 180.20
Synonyms: Benzoic acid, 4-(hydroxymethyl)-3-methyl-, methyl ester
SMILES: O=C(OC)C1=CC=C(CO)C(C)=C1
Tpsa: 46.53
Logp: 1.27392
H Acceptors: 3
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:
C₁₀H₁₂O₃
Molecular Weight:
180.20
Synonyms:
Benzoic acid, 4-(hydroxymethyl)-3-methyl-, methyl ester
SMILES:
O=C(OC)C1=CC=C(CO)C(C)=C1
Tpsa:
46.53
Logp:
1.27392
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2