CS-1156862
2-(3a-(Methoxymethyl)octahydro-2H-isoindol-2-yl)acetic acid
Manufacturer: ChemScene
CAS Number: 2097985-41-4
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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
C₁₂H₂₁NO₃
Molecular Weight
227.30
Synonyms
None
SMILES
O=C(O)CN1CC2CCCCC2(COC)C1
Tpsa
49.77
Logp
1.2096
H Acceptors
3
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: C₁₂H₂₁NO₃
Molecular Weight: 227.30
Synonyms: None
SMILES: O=C(O)CN1CC2CCCCC2(COC)C1
Tpsa: 49.77
Logp: 1.2096
H Acceptors: 3
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:
C₁₂H₂₁NO₃
Molecular Weight:
227.30
Synonyms:
None
SMILES:
O=C(O)CN1CC2CCCCC2(COC)C1
Tpsa:
49.77
Logp:
1.2096
H Acceptors:
3
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: C₁₁H₁₂N₂O₂
Molecular Weight: 204.23
Synonyms: None
SMILES: N=1OC(=C(OC=2C=CC=CC2N)C1C)C
Tpsa: 61.28
Logp: 2.66594
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:
C₁₁H₁₂N₂O₂
Molecular Weight:
204.23
Synonyms:
None
SMILES:
N=1OC(=C(OC=2C=CC=CC2N)C1C)C
Tpsa:
61.28
Logp:
2.66594
H Acceptors:
4
H Donors:
1
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: C₇H₁₀N₂O₂S
Molecular Weight: 186.23
Synonyms: None
SMILES: O=C(OC)CC1=CNC(=S)N1C
Tpsa: 47.02
Logp: 0.79819
H Acceptors: 4
H Donors: 1
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:
C₇H₁₀N₂O₂S
Molecular Weight:
186.23
Synonyms:
None
SMILES:
O=C(OC)CC1=CNC(=S)N1C
Tpsa:
47.02
Logp:
0.79819
H Acceptors:
4
H Donors:
1
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: C₈H₇ClF₂N₂O₂
Molecular Weight: 236.60
Synonyms: None
SMILES: O=C(N)C1=CC(=C(Cl)N=C1OC)C(F)F
Tpsa: 65.21
Logp: 1.7801
H Acceptors: 3
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:
C₈H₇ClF₂N₂O₂
Molecular Weight:
236.60
Synonyms:
None
SMILES:
O=C(N)C1=CC(=C(Cl)N=C1OC)C(F)F
Tpsa:
65.21
Logp:
1.7801
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3