CS-0745729
4-((1R,2S)-2-Amino-3-fluoro-1-hydroxypropyl)benzoic acid
Manufacturer: ChemScene
CAS Number: 2166219-09-4
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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
C₁₀H₁₂FNO₃
Molecular Weight
213.21
Synonyms
None
SMILES
N[C@H](CF)[C@H](O)C1=CC=C(C=C1)C(O)=O
Tpsa
83.55
Logp
0.715
H Acceptors
3
H Donors
3
Rotatable Bonds
4
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: C₁₀H₁₂FNO₃
Molecular Weight: 213.21
Synonyms: None
SMILES: N[C@H](CF)[C@H](O)C1=CC=C(C=C1)C(O)=O
Tpsa: 83.55
Logp: 0.715
H Acceptors: 3
H Donors: 3
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:
C₁₀H₁₂FNO₃
Molecular Weight:
213.21
Synonyms:
None
SMILES:
N[C@H](CF)[C@H](O)C1=CC=C(C=C1)C(O)=O
Tpsa:
83.55
Logp:
0.715
H Acceptors:
3
H Donors:
3
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: C₂₅H₂₃N₃O₃
Molecular Weight: 413.47
Synonyms: None
SMILES: OCC(CC1=CN(C=N1)C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[N+]([O-])=O
Tpsa: 81.19
Logp: 3.9034
H Acceptors: 5
H Donors: 1
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:
C₂₅H₂₃N₃O₃
Molecular Weight:
413.47
Synonyms:
None
SMILES:
OCC(CC1=CN(C=N1)C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)[N+]([O-])=O
Tpsa:
81.19
Logp:
3.9034
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
8
Purity: 98%
MDL No: MFCD09953976
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₄FN₃O
Molecular Weight: 235.26
Synonyms: None
SMILES: FC1=CC=C2N(C3CCNCC3)C(=O)NC2=C1
Tpsa: 49.82
Logp: 1.3932
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD09953976
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₄FN₃O
Molecular Weight:
235.26
Synonyms:
None
SMILES:
FC1=CC=C2N(C3CCNCC3)C(=O)NC2=C1
Tpsa:
49.82
Logp:
1.3932
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: C₄H₇ClO
Molecular Weight: 106.55
Synonyms: None
SMILES: ClCC1CCO1
Tpsa: 9.23
Logp: 1.0141
H Acceptors: 1
H Donors: 0
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:
C₄H₇ClO
Molecular Weight:
106.55
Synonyms:
None
SMILES:
ClCC1CCO1
Tpsa:
9.23
Logp:
1.0141
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
1