3- (Ethylamino) phenol

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CAS Number

621-31-8

MDL Number

MFCD00059617

Purity

95%

Smiles

CCNc1cccc(O)c1

Chemical Information

3-Ethylaminophenol

3-ethylaminophenol is a very viscous deep orange liquid. (NTP, 1992)

CAS Number	621-31-8
PubChem CID	578991
IUPAC Name	3-(ethylamino)phenol
Molecular Formula	C8H11NO
Molecular Weight	137.18
XLogP	1.9
Topological Polar Surface Area	32.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	10
Formal Charge	0
Complexity	95

SMILES

CCNC1=CC(=CC=C1)O

InChI

InChI=1S/C8H11NO/c1-2-9-7-4-3-5-8(10)6-7/h3-6,9-10H,2H2,1H3

InChIKey

TVKZDKSHNITMRZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 621-31-8

CID: 578991

Formula: C8H11NO

MW: 137.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	137.18
XLogP3	1.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	137.084063974
Monoisotopic Mass	137.084063974
Topological Polar Surface Area	32.3 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	95.3
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
OR926076-01	3-[ (Ethylamino) methyl]phenol
OR1057421-01	4- (Ethylamino) phenol
OR52438	2- (Ethylamino) -phenol
OR32804-01	4-Bromo-3-[ (ethylamino) methyl]phenol
OR957514	3-Chloro-2-[ (ethylamino) methyl]phenol
OR957466-01	2-[ (Ethylamino) methyl]phenol
OR927556-01	4-[ (Ethylamino) methyl]phenol
OR52664-01	3-[2- (Ethylamino) -1-hydroxyethyl]phenol hydrochloride
OR1055866-01	4-Bromo-2-[ (ethylamino) methyl]phenol
OR929764-01	4-Chloro-2-[ (ethylamino) methyl]phenol

Catalog	Name
TRC-B434083-1G	3-(Ethylamino)phenol
AAA62131-01	3- (Ethylamino) phenol
FE33553	3- (Ethylamino) phenol Hemisulfate
WEB63708-01	4- (Ethylamino) phenol hydrochloride
TRC-E685080-100MG	3-(1-(Ethylamino)cyclohexyl)phenol
SBA31378	4-bromo-2-[ (ethylamino) methyl]phenol
sc-345870	3-[1- (ethylamino) ethyl]phenol hydrobromide
TRC-E685082-50MG	3-(1-(Ethylamino)cyclohexyl)phenol Hydrochloride
CXB29969-01	2-Ethoxy-4-[ (ethylamino) methyl]phenol hydrochloride
RG-E140774-01	(S) -3- (2- (ethylamino) -1-hydroxyethyl) phenol