2- (Dimethylamino) pentanoic acid

CAT: 0926-JAC29431-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-JAC29431-01Size:50 mg

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CAS Number

1259294-31-9

MDL Number

MFCD12064814

Smiles

CCCC (C (=O) O) N (C) C

Molecular Formula

C7H15NO2

Molecular Weight

145.2 g/mol

Controlled

Chemical Information

2-(Dimethylamino)pentanoic acid

CAS Number	1259294-31-9
PubChem CID	17883462
IUPAC Name	2-(dimethylamino)pentanoic acid
Molecular Formula	C7H15NO2
Molecular Weight	145.20
XLogP	-1.1
Topological Polar Surface Area	40.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	10
Formal Charge	0
Complexity	112

SMILES

CCCC(C(=O)O)N(C)C

InChI

InChI=1S/C7H15NO2/c1-4-5-6(7(9)10)8(2)3/h6H,4-5H2,1-3H3,(H,9,10)

InChIKey

HVNMCCPQUIEPCT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1259294-31-9

CID: 17883462

Formula: C7H15NO2

MW: 145.20

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	145.20
XLogP3	-1.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	145.110278721
Monoisotopic Mass	145.110278721
Topological Polar Surface Area	40.5 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	112
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
KHD06206-01	4- (Dimethylamino) pentanoic acid hydrochloride
UND41954-01	3-[ (Dimethylamino) methyl]pentanoic acid hydrochloride
ZZB74620-01	2- (Cyclopentylmethyl) pentanoic acid
FM01022	2-Methyl pentanoic acid
DFC83964-01	2- (Methoxycarbonyl) pentanoic acid
FCA51299-01	2- (Carbamoylamino) pentanoic acid
EEA88353-01	2- (Aminomethyl) pentanoic acid
LGA08994-01	2- (Cyclohexylmethyl) pentanoic acid
QCA41501-01	2- (2-Phenylacetamido) pentanoic acid
VCA77756-01	2- (2-Phenylethyl) pentanoic acid

Catalog	Name
OR930116-01	5- (Dimethylamino) pentanoic acid
OR927457	5- (Dimethylamino) -pentanoic acid hydrochloride
TRC-B648758-250MG	(S)-2-((tert-Butoxycarbonyl)amino)-5-(dimethylamino)pentanoic Acid
HY-N6056	Pentanoic acid
HY-157258	Trimethoprim pentanoic acid
TMIJ-0428-01	Pentanoic-d9 Acid
LC-17399.1	Pentanoic acid for synthesis
Q-2725.0005	5-Azido-pentanoic acid
TRC-D492135-250MG	5-(Diphenylphosphinyl)pentanoic Acid
434670-01	5- (Phenylmethoxy) pentanoic Acid