CS-1069051
Methyl 4-bromo-3-nitro-5-(trifluoromethyl)benzoate
Manufacturer: ChemScene
CAS Number: 2702975-85-5
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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
C₉H₅BrF₃NO₄
Molecular Weight
328.04
Synonyms
None
SMILES
O=C(OC)C=1C=C(C(Br)=C(C1)C(F)(F)F)N(=O)=O
Tpsa
69.44
Logp
3.1627
H Acceptors
4
H Donors
0
Rotatable Bonds
2
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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: C₉H₅BrF₃NO₄
Molecular Weight: 328.04
Synonyms: None
SMILES: O=C(OC)C=1C=C(C(Br)=C(C1)C(F)(F)F)N(=O)=O
Tpsa: 69.44
Logp: 3.1627
H Acceptors: 4
H Donors: 0
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:
C₉H₅BrF₃NO₄
Molecular Weight:
328.04
Synonyms:
None
SMILES:
O=C(OC)C=1C=C(C(Br)=C(C1)C(F)(F)F)N(=O)=O
Tpsa:
69.44
Logp:
3.1627
H Acceptors:
4
H Donors:
0
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: C₇H₁₆ClNO
Molecular Weight: 165.66
Synonyms: None
SMILES: Cl.O(C)C1CNC(C)CC1
Tpsa: 21.26
Logp: 1.1951
H Acceptors: 2
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:
C₇H₁₆ClNO
Molecular Weight:
165.66
Synonyms:
None
SMILES:
Cl.O(C)C1CNC(C)CC1
Tpsa:
21.26
Logp:
1.1951
H Acceptors:
2
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: C₁₂H₉F₃N₂O₅
Molecular Weight: 318.21
Synonyms: None
SMILES: O=C(O)C1=CC=C(OC(F)(F)F)C(=C1)N2C(=O)NC(=O)CC2
Tpsa: 95.94
Logp: 1.7297
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:
C₁₂H₉F₃N₂O₅
Molecular Weight:
318.21
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(OC(F)(F)F)C(=C1)N2C(=O)NC(=O)CC2
Tpsa:
95.94
Logp:
1.7297
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: C₁₀H₁₀FN₃O₂
Molecular Weight: 223.20
Synonyms: None
SMILES: O=C1NC(=O)CCN1C2=CC=C(F)C(N)=C2
Tpsa: 75.43
Logp: 0.8542
H Acceptors: 3
H Donors: 2
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:
C₁₀H₁₀FN₃O₂
Molecular Weight:
223.20
Synonyms:
None
SMILES:
O=C1NC(=O)CCN1C2=CC=C(F)C(N)=C2
Tpsa:
75.43
Logp:
0.8542
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
1