CS-0767209
Dimethyl 5-(4-(Methoxycarbonyl)-2-nitrophenoxy)isophthalate
Manufacturer: ChemScene
CAS Number: 100596-39-2
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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
C₁₈H₁₅NO₉
Molecular Weight
389.31
Synonyms
None
SMILES
COC(=O)C1=CC(=C(OC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C=C1)[N+]([O-])=O
Tpsa
131.27
Logp
2.7469
H Acceptors
9
H Donors
0
Rotatable Bonds
6
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 100596-39-2 | 1,3-Benzenedicarboxylic acid, 5-[4-(methoxycarbonyl)-2-nitrophenoxy]-, 1,3-dimethyl ester | A2B Chem | -- |
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: C₁₈H₁₅NO₉
Molecular Weight: 389.31
Synonyms: None
SMILES: COC(=O)C1=CC(=C(OC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C=C1)[N+]([O-])=O
Tpsa: 131.27
Logp: 2.7469
H Acceptors: 9
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₁₅NO₉
Molecular Weight:
389.31
Synonyms:
None
SMILES:
COC(=O)C1=CC(=C(OC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C=C1)[N+]([O-])=O
Tpsa:
131.27
Logp:
2.7469
H Acceptors:
9
H Donors:
0
Rotatable Bonds:
6
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₁₅NO₆S
Molecular Weight: 373.38
Synonyms: None
SMILES: COC(=O)C(=O)C1=CC2=CC(OC)=CC=C2N1S(=O)(=O)C1=CC=CC=C1
Tpsa: 91.67
Logp: 2.2426
H Acceptors: 7
H Donors: 0
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:
C₁₈H₁₅NO₆S
Molecular Weight:
373.38
Synonyms:
None
SMILES:
COC(=O)C(=O)C1=CC2=CC(OC)=CC=C2N1S(=O)(=O)C1=CC=CC=C1
Tpsa:
91.67
Logp:
2.2426
H Acceptors:
7
H Donors:
0
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: C₁₆H₂₁NO₅
Molecular Weight: 307.34
Synonyms: None
SMILES: O=C(C1=C(C(CC)=O)C=CC=C1NC(CC(C)C)C(O)=O)O
Tpsa: 103.7
Logp: 2.8887
H Acceptors: 4
H Donors: 3
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₁NO₅
Molecular Weight:
307.34
Synonyms:
None
SMILES:
O=C(C1=C(C(CC)=O)C=CC=C1NC(CC(C)C)C(O)=O)O
Tpsa:
103.7
Logp:
2.8887
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₃N₃O
Molecular Weight: 227.26
Synonyms: None
SMILES: CC1=CC(N=C2C=CC(=O)C=C2)=C(N)C=C1N
Tpsa: 81.47
Logp: 1.92702
H Acceptors: 4
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:
C₁₃H₁₃N₃O
Molecular Weight:
227.26
Synonyms:
None
SMILES:
CC1=CC(N=C2C=CC(=O)C=C2)=C(N)C=C1N
Tpsa:
81.47
Logp:
1.92702
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
1