CS-0061181
3-Bromo-4-methyl-5-nitro-benzoic acid methyl ester
Manufacturer: ChemScene
CAS Number: 223519-08-2
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Purity
98%
MDL No
MFCD07367995
Storage
Store at room temperature
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₉H₈BrNO₄
Molecular Weight
274.07
Synonyms
Methyl 3-bromo-4-methyl-5-nitrobenzoate
SMILES
CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)OC)Br
Tpsa
69.44
Logp
2.45232
H Acceptors
4
H Donors
0
Rotatable Bonds
2
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: MFCD07367995
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₈BrNO₄
Molecular Weight: 274.07
Synonyms: Methyl 3-bromo-4-methyl-5-nitrobenzoate
SMILES: CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)OC)Br
Tpsa: 69.44
Logp: 2.45232
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD07367995
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₈BrNO₄
Molecular Weight:
274.07
Synonyms:
Methyl 3-bromo-4-methyl-5-nitrobenzoate
SMILES:
CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)OC)Br
Tpsa:
69.44
Logp:
2.45232
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₈BrFO₂
Molecular Weight: 247.06
Synonyms: Benzoic acid, 3-bromo-5-fluoro-2-methyl-, methyl ester
SMILES: CC1=C(C=C(C=C1Br)F)C(=O)OC
Tpsa: 26.3
Logp: 2.68322
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₈BrFO₂
Molecular Weight:
247.06
Synonyms:
Benzoic acid, 3-bromo-5-fluoro-2-methyl-, methyl ester
SMILES:
CC1=C(C=C(C=C1Br)F)C(=O)OC
Tpsa:
26.3
Logp:
2.68322
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD00013526
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₈Br₂O
Molecular Weight: 279.96
Synonyms: Anisole,3,5-dibromo-4-methyl- (7CI,8CI)
SMILES: CC1=C(C=C(C=C1Br)OC)Br
Tpsa: 9.23
Logp: 3.52862
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD00013526
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₈Br₂O
Molecular Weight:
279.96
Synonyms:
Anisole,3,5-dibromo-4-methyl- (7CI,8CI)
SMILES:
CC1=C(C=C(C=C1Br)OC)Br
Tpsa:
9.23
Logp:
3.52862
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
1
Purity: 97%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₀N₂O₂
Molecular Weight: 166.18
Synonyms: 3,5-diamino-4-methyl-benzoic acid
SMILES: CC1=C(C=C(C=C1N)C(=O)O)N
Tpsa: 89.34
Logp: 0.85762
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₀N₂O₂
Molecular Weight:
166.18
Synonyms:
3,5-diamino-4-methyl-benzoic acid
SMILES:
CC1=C(C=C(C=C1N)C(=O)O)N
Tpsa:
89.34
Logp:
0.85762
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
1