CS-0327836
Dimethyl 2-(2-chloro-4-nitrobenzamido)terephthalate
Manufacturer: ChemScene
CAS Number: 328258-80-6
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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
C₁₇H₁₃ClN₂O₇
Molecular Weight
392.75
Synonyms
dimethyl 2-({2-chloro-4-nitrobenzoyl}amino)terephthalate
SMILES
COC(C1=CC(NC(C2=C(Cl)C=C([N+]([O-])=O)C=C2)=O)=C(C(OC)=O)C=C1)=O
Tpsa
124.84
Logp
3.0737
H Acceptors
7
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₃ClN₂O₇
Molecular Weight: 392.75
Synonyms: dimethyl 2-({2-chloro-4-nitrobenzoyl}amino)terephthalate
SMILES: COC(C1=CC(NC(C2=C(Cl)C=C([N+]([O-])=O)C=C2)=O)=C(C(OC)=O)C=C1)=O
Tpsa: 124.84
Logp: 3.0737
H Acceptors: 7
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:
C₁₇H₁₃ClN₂O₇
Molecular Weight:
392.75
Synonyms:
dimethyl 2-({2-chloro-4-nitrobenzoyl}amino)terephthalate
SMILES:
COC(C1=CC(NC(C2=C(Cl)C=C([N+]([O-])=O)C=C2)=O)=C(C(OC)=O)C=C1)=O
Tpsa:
124.84
Logp:
3.0737
H Acceptors:
7
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: C₁₈H₁₉NO₃S
Molecular Weight: 329.41
Synonyms: None
SMILES: CC1=CC(C(NC2=C(C(OC)=O)C3=C(S2)CCCC3)=O)=CC=C1
Tpsa: 55.4
Logp: 3.97422
H Acceptors: 4
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:
C₁₈H₁₉NO₃S
Molecular Weight:
329.41
Synonyms:
None
SMILES:
CC1=CC(C(NC2=C(C(OC)=O)C3=C(S2)CCCC3)=O)=CC=C1
Tpsa:
55.4
Logp:
3.97422
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₂N₂O₄
Molecular Weight: 354.40
Synonyms: None
SMILES: CC1(C)CC(=O)C2=C(C1)OC(=C(C#N)C2C3=CC=C(C=C3OC)OC)N
Tpsa: 94.57
Logp: 3.15468
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₂N₂O₄
Molecular Weight:
354.40
Synonyms:
None
SMILES:
CC1(C)CC(=O)C2=C(C1)OC(=C(C#N)C2C3=CC=C(C=C3OC)OC)N
Tpsa:
94.57
Logp:
3.15468
H Acceptors:
6
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: C₁₁H₁₀BrNO₃
Molecular Weight: 284.11
Synonyms: ethyl 4-bromo-2-cyanophenoxyacetate
SMILES: CCOC(=O)COC1=CC=C(C=C1C#N)Br
Tpsa: 59.32
Logp: 2.26268
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₀BrNO₃
Molecular Weight:
284.11
Synonyms:
ethyl 4-bromo-2-cyanophenoxyacetate
SMILES:
CCOC(=O)COC1=CC=C(C=C1C#N)Br
Tpsa:
59.32
Logp:
2.26268
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
4