CS-0329681
2-(2,4-Dimethoxyphenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1087749-08-3
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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
C₁₇H₁₇NO₆
Molecular Weight
331.32
Synonyms
None
SMILES
COC1=CC(=C(C=C1)N2CC34C=CC(C(C3C2=O)C(=O)O)O4)OC
Tpsa
85.3
Logp
1.0748
H Acceptors
5
H Donors
1
Rotatable Bonds
4
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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: C₁₇H₁₇NO₆
Molecular Weight: 331.32
Synonyms: None
SMILES: COC1=CC(=C(C=C1)N2CC34C=CC(C(C3C2=O)C(=O)O)O4)OC
Tpsa: 85.3
Logp: 1.0748
H Acceptors: 5
H Donors: 1
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:
C₁₇H₁₇NO₆
Molecular Weight:
331.32
Synonyms:
None
SMILES:
COC1=CC(=C(C=C1)N2CC34C=CC(C(C3C2=O)C(=O)O)O4)OC
Tpsa:
85.3
Logp:
1.0748
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
4
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₅NO₄
Molecular Weight: 249.26
Synonyms: 2-(3-nitrophenyl)hexahydro-1,3-benzodioxole
SMILES: C1CCC2C(C1)OC(C3=CC(=CC=C3)[N+](=O)[O-])O2
Tpsa: 61.6
Logp: 2.9514
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 2
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₅NO₄
Molecular Weight:
249.26
Synonyms:
2-(3-nitrophenyl)hexahydro-1,3-benzodioxole
SMILES:
C1CCC2C(C1)OC(C3=CC(=CC=C3)[N+](=O)[O-])O2
Tpsa:
61.6
Logp:
2.9514
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₈ClNO₂
Molecular Weight: 173.60
Synonyms: 6-Chloro-2,3-dimethoxy-pyridine
SMILES: COC1=C(N=C(C=C1)Cl)OC
Tpsa: 31.35
Logp: 1.7522
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 2
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₈ClNO₂
Molecular Weight:
173.60
Synonyms:
6-Chloro-2,3-dimethoxy-pyridine
SMILES:
COC1=C(N=C(C=C1)Cl)OC
Tpsa:
31.35
Logp:
1.7522
H Acceptors:
3
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: C₈H₇N₅O₂
Molecular Weight: 205.17
Synonyms: None
SMILES: C1=NC=C(C2=NNC(=N2)CC(=O)O)N=C1
Tpsa: 104.65
Logp: -0.1112
H Acceptors: 5
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:
C₈H₇N₅O₂
Molecular Weight:
205.17
Synonyms:
None
SMILES:
C1=NC=C(C2=NNC(=N2)CC(=O)O)N=C1
Tpsa:
104.65
Logp:
-0.1112
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
3