AG003LBT

39216-86-9 | 4-Ethylamino-1-butanol

AG003LBT

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CAS Number	39216-86-9
Catalog Number	AG003LBT(AGN-PC-0WCAT3)
Chemical Name	4-Ethylamino-1-butanol
IUPAC Name	4-(ethylamino)butan-1-ol
InChI	InChI=1S/C6H15NO/c1-2-7-5-3-4-6-8/h7-8H,2-6H2,1H3
InChI Key	PVNNOLUAMRODAC-UHFFFAOYSA-N
MDL Number	MFCD00671534
Molecular Formula	C6H15NO
Molecular Weight	117.1894
SMILES	OCCCCNCC
Synonyms	4-Ethylamino-1-butanol, 4-(ethylamino)butan-1-ol, 39216-86-9, PVNNOLUAMRODAC-UHFFFAOYSA-N, N-Ethylbutanolamine, 4-ethylaminobutan-1-ol, ACMC-1AGB2, AC1LC2X7, AC1Q31LQ, 1-Butanol,4-(ethylamino)-, 4-(Ethylamino);butan-1-ol, SCHEMBL338884, 1-Butanol, 4-(ethylamino)-, CTK4I1118, PVNNOLUAMRODAC-UHFFFAOYSA-, DTXSID70338140, KS-000015BQ, ZINC2567300, 2370AE, ANW-29035, MFCD00671534, SBB052126, 4-(Ethylamino)-1-butanol AldrichCPR, AKOS009157693, 4-(Ethylamino)-1-butanol, AldrichCPR, DB-049876, TC-117780, E0473, FT-0745306, I14-100263, InChI=1/C6H15NO/c1-2-7-5-3-4-6-8/h7-8H,2-6H2,1H3, 4-(ethylamino)-1-butanol, C6H15NO, CID546882,

Complexity	39.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	117.115g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	117.192g/mol
Monoisotopic Mass	117.115g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	32.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H227-H315-H319
Packing Group
Precautionary statements	P210-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P370+P378-P403+P235-P501
UN Code

Certificate of Analysis

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