CS-1090604
4-(Benzyl(methyl)amino)-3-nitrobenzoic acid
Manufacturer: ChemScene
CAS Number: 361157-61-1
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Purity
≥95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₅H₁₄N₂O₄
Molecular Weight
286.28
Synonyms
None
SMILES
O=C(O)C1=CC=C(C(=C1)N(=O)=O)N(C)CC=2C=CC=CC2
Tpsa
83.68
Logp
2.9294
H Acceptors
4
H Donors
1
Rotatable Bonds
5
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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: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₄N₂O₄
Molecular Weight: 286.28
Synonyms: None
SMILES: O=C(O)C1=CC=C(C(=C1)N(=O)=O)N(C)CC=2C=CC=CC2
Tpsa: 83.68
Logp: 2.9294
H Acceptors: 4
H Donors: 1
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:
C₁₅H₁₄N₂O₄
Molecular Weight:
286.28
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(C(=C1)N(=O)=O)N(C)CC=2C=CC=CC2
Tpsa:
83.68
Logp:
2.9294
H Acceptors:
4
H Donors:
1
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: C₈H₁₄O
Molecular Weight: 126.20
Synonyms: None
SMILES: [C@H]([C@@H](C#C)O)(CCC)C
Tpsa: 20.23
Logp: 1.4167
H Acceptors: 1
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:
C₈H₁₄O
Molecular Weight:
126.20
Synonyms:
None
SMILES:
[C@H]([C@@H](C#C)O)(CCC)C
Tpsa:
20.23
Logp:
1.4167
H Acceptors:
1
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: C₁₁H₁₂N₂O₂S
Molecular Weight: 236.29
Synonyms: None
SMILES: O=C(OCC)NC=1C=CC=2SC(=NC2C1)C
Tpsa: 51.22
Logp: 3.17312
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:
C₁₁H₁₂N₂O₂S
Molecular Weight:
236.29
Synonyms:
None
SMILES:
O=C(OCC)NC=1C=CC=2SC(=NC2C1)C
Tpsa:
51.22
Logp:
3.17312
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: C₇HF₃N₄
Molecular Weight: 198.10
Synonyms: None
SMILES: N#CC1=NC=C(N=C1C#N)C(F)(F)F
Tpsa: 73.36
Logp: 1.23876
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇HF₃N₄
Molecular Weight:
198.10
Synonyms:
None
SMILES:
N#CC1=NC=C(N=C1C#N)C(F)(F)F
Tpsa:
73.36
Logp:
1.23876
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
0