AG003M7C

4272-77-9 | 5-(Dimethylamino)naphthalene-1-sulfonic acid

AG003M7C

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CAS Number	4272-77-9
Catalog Number	AG003M7C(AGN-PC-0WANKZ)
Chemical Name	5-(Dimethylamino)naphthalene-1-sulfonic acid
EC Number	224-268-5
IUPAC Name	5-(dimethylamino)naphthalene-1-sulfonic acid
InChI	InChI=1S/C12H13NO3S/c1-13(2)11-7-3-6-10-9(11)5-4-8-12(10)17(14,15)16/h3-8H,1-2H3,(H,14,15,16)
InChI Key	BBEQQKBWUHCIOU-UHFFFAOYSA-N
MDL Number	MFCD00003995
Molecular Formula	C12H13NO3S
Molecular Weight	251.3015
SMILES	O=S(C1=C2C=CC=C(N(C)C)C2=CC=C1)(O)=O
Synonyms	5-(dimethylamino)-1-naphthalenesulfonic acid, dansyl acid, Dansyl acid, 4272-77-9, 5-(dimethylamino)naphthalene-1-sulfonic acid, 5-Dimethylaminonaphthalene-1-sulfonic Acid, 5-(DIMETHYLAMINO)-1-NAPHTHALENESULFONIC ACID, 1-Naphthalenesulfonic acid, 5-(dimethylamino)-, 5-(dimethylamino)-1-naphthalenesulfonic acid(dansyl acid), 5-(dimethylamino)naphthalenesulfonic acid, 5-Dimethylamino-1-naphthalenesulfonic acid, DansylAcid, EINECS 224-268-5, AC1Q6WSH, 5-(Dimethylamino)naphthalene-1-sulphonic acid, ACMC-209tg2, AC1L1C8X, ARONIS24290, SCHEMBL133520, DTXSID8063383, BBEQQKBWUHCIOU-UHFFFAOYSA-, CTK1D5961, BBC/446, BBEQQKBWUHCIOU-UHFFFAOYSA-N, KS-000013MK, ZINC2140948, ZX-AS004650, ANW-42432, MFCD00003995, SBB057751, SBB080735, STL290518, AKOS005267186, ACM4272779, AN-6631, DB07376, MCULE-2606823477, KS-0000472B, 1-dimethylaminonaphthalene-5-sulfonic acid, RT-002261, FT-0624415, ST45053944, ST51006957, Z3124, 1-Naphthalenesulfonicacid, 5-(dimethylamino)-, C-30135, SR-01000310386, I04-9616, SR-01000310386-1, InChI=1/C12H13NO3S/c1-13(2)11-7-3-6-10-9(11)5-4-8-12(10)17(14,15)16/h3-8H,1-2H3,(H,14,15,16), C12H13NO3S, CID1792, C12-H13-N-O3-S, AR-1G5570, D1426, 5-(Dimethylamino)-1-naphthalenesulfonic acid hydrate, 98% - 25G 25g, 4628-12-0, 6626-57-9, ANS,

Complexity	360
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	251.062g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	251.3g/mol
Monoisotopic Mass	251.062g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	66A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

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