CS-0998354
(S)-2-Amino-3-(4-iodophenyl)propanenitrile
Manufacturer: ChemScene
CAS Number: 1159630-53-1
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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
C₉H₉IN₂
Molecular Weight
272.09
Synonyms
None
SMILES
C([C@@H](C#N)N)C1=CC=C(I)C=C1
Tpsa
49.81
Logp
1.68458
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: C₉H₉IN₂
Molecular Weight: 272.09
Synonyms: None
SMILES: C([C@@H](C#N)N)C1=CC=C(I)C=C1
Tpsa: 49.81
Logp: 1.68458
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:
C₉H₉IN₂
Molecular Weight:
272.09
Synonyms:
None
SMILES:
C([C@@H](C#N)N)C1=CC=C(I)C=C1
Tpsa:
49.81
Logp:
1.68458
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: C₁₂H₁₂N₂O
Molecular Weight: 200.24
Synonyms: None
SMILES: O=C1C2=CC=C3NN=CC3=C2CCCC1
Tpsa: 45.75
Logp: 2.472
H Acceptors: 2
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:
C₁₂H₁₂N₂O
Molecular Weight:
200.24
Synonyms:
None
SMILES:
O=C1C2=CC=C3NN=CC3=C2CCCC1
Tpsa:
45.75
Logp:
2.472
H Acceptors:
2
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: C₁₂H₂₁NO₅
Molecular Weight: 259.30
Synonyms: None
SMILES: O=C(OC(C)(C)C)N1CC(C(=O)O)(COCC)C1
Tpsa: 76.07
Logp: 1.3446
H Acceptors: 4
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:
C₁₂H₂₁NO₅
Molecular Weight:
259.30
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N1CC(C(=O)O)(COCC)C1
Tpsa:
76.07
Logp:
1.3446
H Acceptors:
4
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: C₁₂H₁₂BrFN₂O
Molecular Weight: 299.14
Synonyms: None
SMILES: FC1=NN(C=2C=CC=C(Br)C12)C3OCCCC3
Tpsa: 27.05
Logp: 3.637
H Acceptors: 3
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:
C₁₂H₁₂BrFN₂O
Molecular Weight:
299.14
Synonyms:
None
SMILES:
FC1=NN(C=2C=CC=C(Br)C12)C3OCCCC3
Tpsa:
27.05
Logp:
3.637
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1