CS-0116974
3-Chloro-n-(phenylacetyl)propanamide
Manufacturer: ChemScene
CAS Number: 4488-98-6
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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
C₁₁H₁₂ClNO₂
Molecular Weight
225.67
Synonyms
None
SMILES
O=C(NC(CC1=CC=CC=C1)=O)CCCl
Tpsa
46.17
Logp
1.5008
H Acceptors
2
H Donors
1
Rotatable Bonds
4
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: C₁₁H₁₂ClNO₂
Molecular Weight: 225.67
Synonyms: None
SMILES: O=C(NC(CC1=CC=CC=C1)=O)CCCl
Tpsa: 46.17
Logp: 1.5008
H Acceptors: 2
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:
C₁₁H₁₂ClNO₂
Molecular Weight:
225.67
Synonyms:
None
SMILES:
O=C(NC(CC1=CC=CC=C1)=O)CCCl
Tpsa:
46.17
Logp:
1.5008
H Acceptors:
2
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: C₂₁H₂₂F₂O₄
Molecular Weight: 376.39
Synonyms: Propanedioic acid, bis[(2-fluorophenyl)methyl]-, diethyl ester (9CI)
SMILES: O=C(OCC)C(CC1=CC=CC=C1F)(CC2=CC=CC=C2F)C(OCC)=O
Tpsa: 52.6
Logp: 3.8626
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₂F₂O₄
Molecular Weight:
376.39
Synonyms:
Propanedioic acid, bis[(2-fluorophenyl)methyl]-, diethyl ester (9CI)
SMILES:
O=C(OCC)C(CC1=CC=CC=C1F)(CC2=CC=CC=C2F)C(OCC)=O
Tpsa:
52.6
Logp:
3.8626
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₆O₄
Molecular Weight: 236.26
Synonyms: None
SMILES: O=C(OCC)CCCOC1=CC=C(C=O)C=C1
Tpsa: 52.6
Logp: 2.2212
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₆O₄
Molecular Weight:
236.26
Synonyms:
None
SMILES:
O=C(OCC)CCCOC1=CC=C(C=O)C=C1
Tpsa:
52.6
Logp:
2.2212
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₉NO₅
Molecular Weight: 211.17
Synonyms: 4-Hydroxy-3-nitrobenzoic acid ethyl ester
SMILES: O=C(OCC)C1=CC=C(O)C([N+]([O-])=O)=C1
Tpsa: 89.67
Logp: 1.4771
H Acceptors: 5
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:
C₉H₉NO₅
Molecular Weight:
211.17
Synonyms:
4-Hydroxy-3-nitrobenzoic acid ethyl ester
SMILES:
O=C(OCC)C1=CC=C(O)C([N+]([O-])=O)=C1
Tpsa:
89.67
Logp:
1.4771
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
3