CS-0653783
4-(1-Methylazetidin-3-yl)benzoic acid
Manufacturer: ChemScene
CAS Number: 1545172-46-0
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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
C₁₁H₁₃NO₂
Molecular Weight
191.23
Synonyms
None
SMILES
O=C(C1=CC=C(C2CN(C2)C)C=C1)O
Tpsa
40.54
Logp
1.4138
H Acceptors
2
H Donors
1
Rotatable Bonds
2
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
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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: C₁₁H₁₃NO₂
Molecular Weight: 191.23
Synonyms: None
SMILES: O=C(C1=CC=C(C2CN(C2)C)C=C1)O
Tpsa: 40.54
Logp: 1.4138
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₃NO₂
Molecular Weight:
191.23
Synonyms:
None
SMILES:
O=C(C1=CC=C(C2CN(C2)C)C=C1)O
Tpsa:
40.54
Logp:
1.4138
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: 4°C, sealed storage, away from moisture and light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₆N₄O₄
Molecular Weight: 210.15
Synonyms: None
SMILES: O=C(C1=NC2=C(OC1)NC(N)=NC2=O)O
Tpsa: 130.66
Logp: -1.0984
H Acceptors: 6
H Donors: 3
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
4°C, sealed storage, away from moisture and light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₆N₄O₄
Molecular Weight:
210.15
Synonyms:
None
SMILES:
O=C(C1=NC2=C(OC1)NC(N)=NC2=O)O
Tpsa:
130.66
Logp:
-1.0984
H Acceptors:
6
H Donors:
3
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: C₉H₁₇NO₃
Molecular Weight: 187.24
Synonyms: None
SMILES: CCOC([C@@H]1C[C@H](CN1)OCC)=O
Tpsa: 47.56
Logp: 0.3165
H Acceptors: 4
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:
C₉H₁₇NO₃
Molecular Weight:
187.24
Synonyms:
None
SMILES:
CCOC([C@@H]1C[C@H](CN1)OCC)=O
Tpsa:
47.56
Logp:
0.3165
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
4
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₆O₃
Molecular Weight: 208.25
Synonyms: None
SMILES: O=C(CC1=CC=C(C=C1)OCC(C)C)O
Tpsa: 46.53
Logp: 2.3485
H Acceptors: 2
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:
C₁₂H₁₆O₃
Molecular Weight:
208.25
Synonyms:
None
SMILES:
O=C(CC1=CC=C(C=C1)OCC(C)C)O
Tpsa:
46.53
Logp:
2.3485
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
5