CS-1172582
(S)-4,4-Difluoro-3-hydroxybutanenitrile
Manufacturer: ChemScene
CAS Number: 3044812-35-0
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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
C₄H₅F₂NO
Molecular Weight
121.09
Synonyms
None
SMILES
N#CC[C@H](O)C(F)F
Tpsa
44.02
Logp
0.52608
H Acceptors
2
H Donors
1
Rotatable Bonds
2
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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: C₄H₅F₂NO
Molecular Weight: 121.09
Synonyms: None
SMILES: N#CC[C@H](O)C(F)F
Tpsa: 44.02
Logp: 0.52608
H Acceptors: 2
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:
C₄H₅F₂NO
Molecular Weight:
121.09
Synonyms:
None
SMILES:
N#CC[C@H](O)C(F)F
Tpsa:
44.02
Logp:
0.52608
H Acceptors:
2
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: C₁₄H₁₈BrNO₄
Molecular Weight: 344.20
Synonyms: None
SMILES: O=C(OC)C(NC(OC(C)(C)C)=O)C1=CC=CC(Br)=C1
Tpsa: 64.63
Logp: 3.1879
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₈BrNO₄
Molecular Weight:
344.20
Synonyms:
None
SMILES:
O=C(OC)C(NC(OC(C)(C)C)=O)C1=CC=CC(Br)=C1
Tpsa:
64.63
Logp:
3.1879
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₂₂N₄O₃
Molecular Weight: 342.39
Synonyms: None
SMILES: O=C(C(N(C(C)C1=C2C=CC(N3CCNCC3)=C1)C2=O)CC4)NC4=O
Tpsa: 81.75
Logp: 0.4182
H Acceptors: 5
H Donors: 2
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:
C₁₈H₂₂N₄O₃
Molecular Weight:
342.39
Synonyms:
None
SMILES:
O=C(C(N(C(C)C1=C2C=CC(N3CCNCC3)=C1)C2=O)CC4)NC4=O
Tpsa:
81.75
Logp:
0.4182
H Acceptors:
5
H Donors:
2
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: C₁₅H₁₅NO₄
Molecular Weight: 273.28
Synonyms: None
SMILES: O=C(C1=CC2=C(C=NC=C2)C=C1C(OC(C)(C)C)=O)O
Tpsa: 76.49
Logp: 2.8883
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:
C₁₅H₁₅NO₄
Molecular Weight:
273.28
Synonyms:
None
SMILES:
O=C(C1=CC2=C(C=NC=C2)C=C1C(OC(C)(C)C)=O)O
Tpsa:
76.49
Logp:
2.8883
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2