CS-0556575
4-(2,3-Dihydrobenzo[b][1,4]dioxine-6-carboxamido)butanoic acid
Manufacturer: ChemScene
CAS Number: 335212-82-3
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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
C₁₃H₁₅NO₅
Molecular Weight
265.26
Synonyms
4-[(2,3-DIHYDRO-BENZO[1,4]DIOXINE-6-CARBONYL)-AMINO]-BUTYRIC ACID
SMILES
C1COC2=C(O1)C=CC(=C2)C(=O)NCCCC(=O)O
Tpsa
84.86
Logp
1.0524
H Acceptors
4
H Donors
2
Rotatable Bonds
5
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: C₁₃H₁₅NO₅
Molecular Weight: 265.26
Synonyms: 4-[(2,3-DIHYDRO-BENZO[1,4]DIOXINE-6-CARBONYL)-AMINO]-BUTYRIC ACID
SMILES: C1COC2=C(O1)C=CC(=C2)C(=O)NCCCC(=O)O
Tpsa: 84.86
Logp: 1.0524
H Acceptors: 4
H Donors: 2
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:
C₁₃H₁₅NO₅
Molecular Weight:
265.26
Synonyms:
4-[(2,3-DIHYDRO-BENZO[1,4]DIOXINE-6-CARBONYL)-AMINO]-BUTYRIC ACID
SMILES:
C1COC2=C(O1)C=CC(=C2)C(=O)NCCCC(=O)O
Tpsa:
84.86
Logp:
1.0524
H Acceptors:
4
H Donors:
2
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: C₁₇H₁₆N₂O
Molecular Weight: 264.32
Synonyms: 4-(P-TOLYLAMINO-METHYL)-1H-QUINOLIN-2-ONE
SMILES: CC1=CC=C(C=C1)NCC2=CC(=O)NC3=CC=CC=C32
Tpsa: 44.89
Logp: 3.44862
H Acceptors: 2
H Donors: 2
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:
C₁₇H₁₆N₂O
Molecular Weight:
264.32
Synonyms:
4-(P-TOLYLAMINO-METHYL)-1H-QUINOLIN-2-ONE
SMILES:
CC1=CC=C(C=C1)NCC2=CC(=O)NC3=CC=CC=C32
Tpsa:
44.89
Logp:
3.44862
H Acceptors:
2
H Donors:
2
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: C₁₇H₂₂N₂OS
Molecular Weight: 302.43
Synonyms: N-{4,5-dimethyl-3-[(propan-2-ylamino)methyl]thiophen-2-yl}benzamide
SMILES: CC1=C(SC(=C1CNC(C)C)NC(=O)C2=CC=CC=C2)C
Tpsa: 41.13
Logp: 4.11524
H Acceptors: 3
H Donors: 2
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:
C₁₇H₂₂N₂OS
Molecular Weight:
302.43
Synonyms:
N-{4,5-dimethyl-3-[(propan-2-ylamino)methyl]thiophen-2-yl}benzamide
SMILES:
CC1=C(SC(=C1CNC(C)C)NC(=O)C2=CC=CC=C2)C
Tpsa:
41.13
Logp:
4.11524
H Acceptors:
3
H Donors:
2
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: C₁₄H₁₅N₃O₃
Molecular Weight: 273.29
Synonyms: 3-({(E)-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}amino)propan-1-ol
SMILES: C1=CN(C(=C1)C=NCCCO)C2=CC=C(C=C2)[N+](=O)[O-]
Tpsa: 80.66
Logp: 2.1868
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₅N₃O₃
Molecular Weight:
273.29
Synonyms:
3-({(E)-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}amino)propan-1-ol
SMILES:
C1=CN(C(=C1)C=NCCCO)C2=CC=C(C=C2)[N+](=O)[O-]
Tpsa:
80.66
Logp:
2.1868
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
6