CS-1066291
(S)-3-(2,2-Difluorobenzo[d][1,3]dioxol-5-yl)-3-hydroxypropanenitrile
Manufacturer: ChemScene
CAS Number: 2639941-30-1
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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
C₁₀H₇F₂NO₃
Molecular Weight
227.16
Synonyms
None
SMILES
[C@@H](CC#N)(O)C=1C=C2C(OC(F)(F)O2)=CC1
Tpsa
62.48
Logp
1.95518
H Acceptors
4
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
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: C₁₀H₇F₂NO₃
Molecular Weight: 227.16
Synonyms: None
SMILES: [C@@H](CC#N)(O)C=1C=C2C(OC(F)(F)O2)=CC1
Tpsa: 62.48
Logp: 1.95518
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:
C₁₀H₇F₂NO₃
Molecular Weight:
227.16
Synonyms:
None
SMILES:
[C@@H](CC#N)(O)C=1C=C2C(OC(F)(F)O2)=CC1
Tpsa:
62.48
Logp:
1.95518
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: C₁₁H₁₅ClN₂O₂S
Molecular Weight: 274.77
Synonyms: None
SMILES: O=C(OCC)C(C)CC1=CN=C(N=C1Cl)SC
Tpsa: 52.08
Logp: 2.5936
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₅ClN₂O₂S
Molecular Weight:
274.77
Synonyms:
None
SMILES:
O=C(OCC)C(C)CC1=CN=C(N=C1Cl)SC
Tpsa:
52.08
Logp:
2.5936
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
5
Purity: 96%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₉BrN₂O
Molecular Weight: 217.06
Synonyms: None
SMILES: C[C@]1(O)C=2N(CC1)C=C(Br)N2
Tpsa: 38.05
Logp: 1.2568
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 0
Purity:
96%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₉BrN₂O
Molecular Weight:
217.06
Synonyms:
None
SMILES:
C[C@]1(O)C=2N(CC1)C=C(Br)N2
Tpsa:
38.05
Logp:
1.2568
H Acceptors:
3
H Donors:
1
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: C₆H₆BrF₃N₂O
Molecular Weight: 259.02
Synonyms: None
SMILES: FC(F)(F)C(O)C1=NC(Br)=CN1C
Tpsa: 38.05
Logp: 1.7783
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:
C₆H₆BrF₃N₂O
Molecular Weight:
259.02
Synonyms:
None
SMILES:
FC(F)(F)C(O)C1=NC(Br)=CN1C
Tpsa:
38.05
Logp:
1.7783
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1