Home Amines 101937-67-1
101937-67-1,MFCD00590283
Catalog No.:AA0005XQ
101937-67-1 | 2-([(4-Chlorophenyl)amino]carbonyl)cyclohexanecarboxylic acid
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1g
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5g
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Technical Information
Catalog Number:
AA0005XQ
Chemical Name:
2-([(4-Chlorophenyl)amino]carbonyl)cyclohexanecarboxylic acid
CAS Number:
101937-67-1
Molecular Formula:
C14H16ClNO3
Molecular Weight:
281.7347
MDL Number:
MFCD00590283
IUPAC Name:
2-[(4-chlorophenyl)carbamoyl]cyclohexane-1-carboxylic acid
InChI:
InChI=1S/C14H16ClNO3/c15-9-5-7-10(8-6-9)16-13(17)11-3-1-2-4-12(11)14(18)19/h5-8,11-12H,1-4H2,(H,16,17)(H,18,19)
InChI Key:
CANPECYEYBATAJ-UHFFFAOYSA-N
SMILES:
O=C(C1CCCCC1C(=O)O)Nc1ccc(cc1)Cl
NSC Number:
164137
Properties
Computed Properties
 
Complexity:
340  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.082g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
281.736g/mol
Monoisotopic Mass:
281.082g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

Synonyms
 
101937-67-1 
2-[(4-chlorophenyl)carbamoyl]cyclohexane-1-carboxylic acid 
Oprea1_417280 
MLS000053099 
CHEMBL1555693 
CTK4A0443 
DTXSID50304085 
HMS2429C11 
ALBB-012008 
KS-000029WQ 
ZX-AN010817 
ZX-AT001561 
2-{[(4-chlorophenyl)amino]carbonyl}cyclohexanecarboxylic acid 
ZX-CM015415 
MFCD00590283 
NSC164137 
AKOS000737035 
AKOS016182606 
MCULE-2733890751 
NSC-164137 
OR10251 
PS-3283 
BAS 00329156 
2-((4-Chlorophenyl)carbamoyl)cyclohexanecarboxylic acid 
SMR000069366 
DB-029283 
FT-0684383 
ST45142449 
VU0012178-6 
K-0266 
AB00078608-01 
I04-4864 
2-(4-Chloro-phenylcarbamoyl)-cyclohexanecarboxylic acid 
F3148-7391 
2-[(4-chloroanilino)carbonyl]cyclohexanecarboxylic acid 
2-[N-(4-Chlorophenyl)carbamoyl]cyclohexanecarboxylic acid 
CANPECYEYBATAJ-UHFFFAOYSA-N 
CID294983 
2-([(4-CHLOROPHENYL)AMINO]CARBONYL)CYCLOHEXANECARBOXYLIC ACID 
cyclohexanecarboxylic acid, 2-[[(4-chlorophenyl)amino]carbonyl]- 
AC1L6N4D 
Cambridge id 5273607 
Oprea1_214709 
Literature

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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