Butyl (2-methoxyethyl) amine

CAT: 0926-ICA20300-01Size: 0.5 gDry Ice: NoHazardous: No

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CAT#:0926-ICA20300-01Size:0.5 g

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CAS Number

58203-00-2

MDL Number

MFCD01098514

Smiles

CCCCNCCOC

Molecular Formula

C7H17NO

Molecular Weight

131.22 g/mol

Controlled

Chemical Information

Butyl(2-methoxyethyl)amine

CAS Number	58203-00-2
PubChem CID	3529507
IUPAC Name	N-(2-methoxyethyl)butan-1-amine
Molecular Formula	C7H17NO
Molecular Weight	131.22
XLogP	0.9
Topological Polar Surface Area	21.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	6
Heavy Atom Count	9
Formal Charge	0
Complexity	48

SMILES

CCCCNCCOC

InChI

InChI=1S/C7H17NO/c1-3-4-5-8-6-7-9-2/h8H,3-7H2,1-2H3

InChIKey

KBFNFQKDHFXGNQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 58203-00-2

CID: 3529507

Formula: C7H17NO

MW: 131.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	131.22
XLogP3	0.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	6
Exact Mass	131.131014166
Monoisotopic Mass	131.131014166
Topological Polar Surface Area	21.3 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	48.2
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
UQB60373-01	(2-Methoxyethyl) (2-methylpropyl) amine
HMB00572-01	(2-Methoxyethyl) (2-phenylethyl) amine
RCA11613-01	Tert-Butyl 2-[ (2-methoxyethyl) amino]acetate
UHB81392-01	Diethyl ({2-[ (2-methoxyethyl) amino]ethyl}) amine
WGA27403-01	(2-Methoxyethyl) (3-methoxypropyl) amine
UQB49928-01	(2-Methoxyethyl) (1-phenylethyl) amine
IVA24184-01	[ (2-Methoxyethyl) (methyl) sulfamoyl]amine
FKA04204-01	(2-Methoxyethyl) (3-phenylpropyl) amine
FDD52414-01	Bis (2-fluoroethyl) (2-methoxyethyl) amine
RCA11620-01	Tert-Butyl 3-[ (2-methoxyethyl) amino]propanoate

Catalog	Name
sc-278747	Benzothiazol-2-yl-butyl-amine
OR959974-01	Butyl (thiophen-2-ylmethyl) amine
OR956970	Butyl[ (2-chlorophenyl) methyl]amine
sc-326513	Butyl-but-2-ynyl-amine hydrochloride
PC108277	Tert-Butyl (2,2,2-trifluoroethyl) amine
JH919476	Tert-Butyl (2-methoxy-2-methylpropyl) amine
sc-356119A	Tert-butyl (pyridin-2-ylmethyl) amine
OR911077-01	N-Butyl-3-nitropyridin-2-amine
OR959972-01	Tert-Butyl (thiophen-2-ylmethyl) amine
OR1034695-01	5- (tert-Butyl) thiazol-2-amine