CS-0553967
N-isobutyl-N-nicotinoylglycine
Manufacturer: ChemScene
CAS Number: 1267110-96-2
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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
C₁₂H₁₆N₂O₃
Molecular Weight
236.27
Synonyms
None
SMILES
O=C(O)CN(CC(C)C)C(C1=CC=CN=C1)=O
Tpsa
70.5
Logp
1.2644
H Acceptors
3
H Donors
1
Rotatable Bonds
5
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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: C₁₂H₁₆N₂O₃
Molecular Weight: 236.27
Synonyms: None
SMILES: O=C(O)CN(CC(C)C)C(C1=CC=CN=C1)=O
Tpsa: 70.5
Logp: 1.2644
H Acceptors: 3
H Donors: 1
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:
C₁₂H₁₆N₂O₃
Molecular Weight:
236.27
Synonyms:
None
SMILES:
O=C(O)CN(CC(C)C)C(C1=CC=CN=C1)=O
Tpsa:
70.5
Logp:
1.2644
H Acceptors:
3
H Donors:
1
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: C₉H₁₂ClFN₂O
Molecular Weight: 218.66
Synonyms: None
SMILES: C[C@@H](C(=O)NC1=CC=CC=C1F)N.Cl
Tpsa: 55.12
Logp: 1.5332
H Acceptors: 2
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:
C₉H₁₂ClFN₂O
Molecular Weight:
218.66
Synonyms:
None
SMILES:
C[C@@H](C(=O)NC1=CC=CC=C1F)N.Cl
Tpsa:
55.12
Logp:
1.5332
H Acceptors:
2
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: C₁₃H₁₈ClF₃N₂O
Molecular Weight: 310.74
Synonyms: (2S)-2-Amino-3-methyl-N-[2-(trifluoromethyl)phenyl]pentanamide hydrochloride
SMILES: CCC(C)[C@H](N)C(NC1=CC=CC=C1C(F)(F)F)=O.[H]Cl
Tpsa: 55.12
Logp: 3.4391
H Acceptors: 2
H Donors: 2
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:
C₁₃H₁₈ClF₃N₂O
Molecular Weight:
310.74
Synonyms:
(2S)-2-Amino-3-methyl-N-[2-(trifluoromethyl)phenyl]pentanamide hydrochloride
SMILES:
CCC(C)[C@H](N)C(NC1=CC=CC=C1C(F)(F)F)=O.[H]Cl
Tpsa:
55.12
Logp:
3.4391
H Acceptors:
2
H Donors:
2
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: C₁₁H₁₅BrN₂O
Molecular Weight: 271.15
Synonyms: None
SMILES: CCN(CC)C(=O)C1=C(C=CC(=C1)Br)N
Tpsa: 46.33
Logp: 2.5133
H Acceptors: 2
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:
C₁₁H₁₅BrN₂O
Molecular Weight:
271.15
Synonyms:
None
SMILES:
CCN(CC)C(=O)C1=C(C=CC(=C1)Br)N
Tpsa:
46.33
Logp:
2.5133
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3