CS-0201730
α-Phenylglycinonitrile hydrochloride
Manufacturer: ChemScene
CAS Number: 53941-45-0
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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
C₈H₉ClN₂
Molecular Weight
168.62
Synonyms
None
SMILES
N[C@@H](C1=CC=CC=C1)C#N.[H]Cl
Tpsa
49.81
Logp
1.63178
H Acceptors
2
H Donors
1
Rotatable Bonds
1
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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
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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: C₈H₉ClN₂
Molecular Weight: 168.62
Synonyms: None
SMILES: N[C@@H](C1=CC=CC=C1)C#N.[H]Cl
Tpsa: 49.81
Logp: 1.63178
H Acceptors: 2
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:
C₈H₉ClN₂
Molecular Weight:
168.62
Synonyms:
None
SMILES:
N[C@@H](C1=CC=CC=C1)C#N.[H]Cl
Tpsa:
49.81
Logp:
1.63178
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD00004188
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₁NO₄
Molecular Weight: 161.16
Synonyms: None
SMILES: CC(CCC(=O)O)(C(=O)O)N
Tpsa: 100.62
Logp: -0.3468
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 4
Purity:
98%
MDL No:
MFCD00004188
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₁NO₄
Molecular Weight:
161.16
Synonyms:
None
SMILES:
CC(CCC(=O)O)(C(=O)O)N
Tpsa:
100.62
Logp:
-0.3468
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
4
Purity: 95+%
MDL No: MFCD00055778
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₈FNO₄
Molecular Weight: 165.12
Synonyms: None
SMILES: C(C(C(=O)O)F)C(C(=O)O)N
Tpsa: 100.62
Logp: -0.7889
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 4
Purity:
95+%
MDL No:
MFCD00055778
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₈FNO₄
Molecular Weight:
165.12
Synonyms:
None
SMILES:
C(C(C(=O)O)F)C(C(=O)O)N
Tpsa:
100.62
Logp:
-0.7889
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: C₄₀H₄₄N₂O₈
Molecular Weight: 680.79
Synonyms: None
SMILES: C(OC(N[C@@H](C(OCC1=CC=C(NC(CC(C)C)=C2C(=O)CC(C)(C)CC2=O)C=C1)=O)CCC(O)=O)=O)C3C=4C(C=5C3=CC=CC5)=CC=CC4
Tpsa: 148.1
Logp: 7.1722
H Acceptors: 8
H Donors: 3
Rotatable Bonds: 13
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₀H₄₄N₂O₈
Molecular Weight:
680.79
Synonyms:
None
SMILES:
C(OC(N[C@@H](C(OCC1=CC=C(NC(CC(C)C)=C2C(=O)CC(C)(C)CC2=O)C=C1)=O)CCC(O)=O)=O)C3C=4C(C=5C3=CC=CC5)=CC=CC4
Tpsa:
148.1
Logp:
7.1722
H Acceptors:
8
H Donors:
3
Rotatable Bonds:
13