CS-1079569
Ethyl (S)-3-amino-3-(1-methyl-1H-benzo[d]imidazol-2-yl)propanoate
Manufacturer: ChemScene
CAS Number: 2920206-68-2
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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
C₁₃H₁₇N₃O₂
Molecular Weight
247.29
Synonyms
None
SMILES
CN1C=2C(N=C1[C@H](CC(OCC)=O)N)=CC=CC2
Tpsa
70.14
Logp
1.5263
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: C₁₃H₁₇N₃O₂
Molecular Weight: 247.29
Synonyms: None
SMILES: CN1C=2C(N=C1[C@H](CC(OCC)=O)N)=CC=CC2
Tpsa: 70.14
Logp: 1.5263
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:
C₁₃H₁₇N₃O₂
Molecular Weight:
247.29
Synonyms:
None
SMILES:
CN1C=2C(N=C1[C@H](CC(OCC)=O)N)=CC=CC2
Tpsa:
70.14
Logp:
1.5263
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: C₆H₈F₃NO₃
Molecular Weight: 199.13
Synonyms: None
SMILES: [C@@](F)(F)(F)[C@@H]1O[C@H](C(O)=O)CNC1
Tpsa: 58.56
Logp: -0.0097
H Acceptors: 3
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:
C₆H₈F₃NO₃
Molecular Weight:
199.13
Synonyms:
None
SMILES:
[C@@](F)(F)(F)[C@@H]1O[C@H](C(O)=O)CNC1
Tpsa:
58.56
Logp:
-0.0097
H Acceptors:
3
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: C₁₂H₁₈ClN₃
Molecular Weight: 239.74
Synonyms: None
SMILES: N[C@@H]1C2(CC=3C1=CC=CN3)CCNCC2.Cl
Tpsa: 50.94
Logp: 1.4291
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₈ClN₃
Molecular Weight:
239.74
Synonyms:
None
SMILES:
N[C@@H]1C2(CC=3C1=CC=CN3)CCNCC2.Cl
Tpsa:
50.94
Logp:
1.4291
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₂ClNO₂
Molecular Weight: 177.63
Synonyms: None
SMILES: C(OC)(=O)[C@@H]1CC=CCN1.Cl
Tpsa: 38.33
Logp: 0.4993
H Acceptors: 3
H Donors: 1
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:
C₇H₁₂ClNO₂
Molecular Weight:
177.63
Synonyms:
None
SMILES:
C(OC)(=O)[C@@H]1CC=CCN1.Cl
Tpsa:
38.33
Logp:
0.4993
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1