AG00AGXC

143376-47-0 | cis-​3,​4-​Diaminotetrahydrofur​an

AG00AGXC

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CAS Number	143376-47-0
Catalog Number	AG00AGXC(AGN-PC-0O2MXK)
Chemical Name	cis-​3,​4-​Diaminotetrahydrofur​an
IUPAC Name	(3S,4R)-oxolane-3,4-diamine
InChI	InChI=1S/C4H10N2O/c5-3-1-7-2-4(3)6/h3-4H,1-2,5-6H2/t3-,4+
InChI Key	VPSJSRRUXSUNFA-ZXZARUISSA-N
MDL Number	MFCD18833625
Molecular Formula	C4H10N2O
Molecular Weight	102.1350
SMILES	N[C@H]1COC[C@H]1N
Synonyms	143376-47-0, cis-3,4-tetrahydrofurandiamine, (3r,4s)-rel-3,4-tetrahydrofurandiamine, 3,4-FURANDIAMINE, TETRAHYDRO-, CIS-, 500571-11-9, (3R,4S)-rel-Tetrahydrofuran-3,4-diamine, 3,4-furandiamine,tetrahydro-,cis-, cis-oxolane-3,4-diamine, SCHEMBL1988050, cis-Tetrahydrofuran-3,4-diamine, VPSJSRRUXSUNFA-ZXZARUISSA-N, FCH994329, MFCD18833625, ZINC34241159, AKOS025119211, (3R,4S)-tetrahydrofuran-3,4-diamine, (3S,4R)-Tetrahydrofuran-3,4-diamine, PB18249, SB10915, KS-0000046L, KS-0000046M, 3,4-furandiamine,tetrahydro-,(3r,4s)-, AJ-87607, AK170848, AS-52797, (3R,4S)-3,4-TETRAHYDROFURANDIAMINE, CS-0049723, 3,4-Furandiamine, tetrahydro-, trans- (9CI), EN300-146339, 3,4-Furandiamine,tetrahydro-,(3R,4R)-(9CI), 3,4-FURANDIAMINE, TETRAHYDRO-, (3R,4S)-, Tetrahydro-furan-3,4-diamine, trans-Tetrahydrofuran-3,4-diamine, (3R,4R)-tetrahydrofuran-3,4-diamine, (3S,4S)-Tetrahydrofuran-3,4-diamine, ACN-046135, 3,4-Furandiamine, tetrahydro-, cis- (9CI), 3,4-Furandiamine, tetrahydro-, (3R,4S)- (9CI), 480450-23-5, 117180-87-7, 45434-73-9, 137277-16-8,

Complexity	58.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	102.079g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	102.137g/mol
Monoisotopic Mass	102.079g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	61.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3(8)
Hazard statements	H225-H314
Packing Group	Ⅲ
Precautionary statements	P210-P243-P273-P280-P305+P351+P338-P310-P403
UN Code	UN 2924

Certificate of Analysis

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