Methyl trans-2-Aminocyclohexanecarboxylate - CAS 161618-50-4

Catalog:	BB011766
Product Name:	Methyl trans-2-Aminocyclohexanecarboxylate
CAS:	161618-50-4
Synonyms:	2-amino-1-cyclohexanecarboxylic acid methyl ester; methyl 2-aminocyclohexane-1-carboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	methyl (1R,2R)-2-aminocyclohexane-1-carboxylate
Description:	Methyl trans-2-Aminocyclohexanecarboxylate (CAS# 161618-50-4 ) is a useful research chemical.
Molecular Weight:	157.21
Molecular Formula:	C8H15NO2
Canonical SMILES:	COC(=O)C1CCCCC1N.COC(=O)C1CCCCC1N
InChI:	InChI=1S/2C8H15NO2/c21-11-8(10)6-4-2-3-5-7(6)9/h26-7H,2-5,9H2,1H3
InChI Key:	KIWSTFVYCGZMJQ-UHFFFAOYSA-N
LogP:	0.00000

Publication Number	Title	Priority Date
WO-2008073982-A2	5,6-dihydro-1h-pyridin-2-one compounds	20061212
US-2007154882-A1	Beta-polypeptides that inhibit cytomegalovirus infection	20050310
US-2005113442-A1	Antiamyloid phenylsulfonamides: N-cycloalkylcarboxamides derivatives	20031126
US-7084178-B2	Antiamyloid phenylsulfonamides: N-cycloalkylcarboxamides derivatives	20031126
WO-2005054180-A1	Antiamyloid phenylsulfonamides: n-cycloalkylcarboxamides derivatives	20031126

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Complexity:	147
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	2
Defined Bond Stereocenter Count:	0
Exact Mass:	157.110278721
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	157.110278721
Rotatable Bond Count:	2
Topological Polar Surface Area:	52.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.1