AG006PLY

96702-03-3 | 4-Pyrimidinecarboxylicacid, 3,4,5,6-tetrahydro-2-methyl-, (4S)-

AG006PLY

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	96702-03-3
Catalog Number	AG006PLY(AGN-PC-0OOG15)
Chemical Name	4-Pyrimidinecarboxylicacid, 3,4,5,6-tetrahydro-2-methyl-, (4S)-
EC Number	431-910-1
IUPAC Name	(6S)-2-methyl-1,4,5,6-tetrahydropyrimidine-6-carboxylic acid
InChI	InChI=1S/C6H10N2O2/c1-4-7-3-2-5(8-4)6(9)10/h5H,2-3H2,1H3,(H,7,8)(H,9,10)/t5-/m0/s1
InChI Key	WQXNXVUDBPYKBA-YFKPBYRVSA-N
MDL Number	MFCD03419286
Molecular Formula	C6H10N2O2
Molecular Weight	142.1558
SMILES	O=C([C@H]1NC(C)=NCC1)O
UNII	7GXZ3858RY
Synonyms	1,4,5,6-tetrahydro-2-methyl-4-pyrimidinecarboxylic acid, ectoin, ectoine, ectoine, 96702-03-3, L-Ectoine, UNII-7GXZ3858RY, Thp(B), 7GXZ3858RY, CHEBI:27592, (4S)-2-methyl-1,4,5,6-tetrahydropyrimidine-4-carboxylic acid, (S)-2-Methyl- 1,4,5,6-tetrahydropyrimidine-4-carboxylic acid, (S)-2-Methyl-1,4,5,6-tetrahydropyrimidine-4-carboxylic acid, (+)-1,4,5,6-tetrahydro-2-methyl-4-pyrimidinecarboxylic acid, 4-Pyrimidinecarboxylicacid, 3,4,5,6-tetrahydro-2-methyl-, (4S)-, SMR000127407, Ectoine, primary pharmaceutical reference standard, (S)-2-Methyl-3,4,5,6-tetrahydropyrimidine-4-carboxylic acid, (4S)-2-methyl-1,4,5,6-tetrahydropyrimidine-4-carboxylate, 4CS, Ectoine, osmoprotectant, AC1L2PNK, SCHEMBL93532, US9138393, Ectoine, US9144538, Ectoine, MLS001332487, MLS001332488, CHEMBL1230264, CTK3I7117, WQXNXVUDBPYKBA-YFKPBYRVSA-N, BDBM181140, Ectoine, >=95.0% (HPLC), EX-A1678, ZINC1612568, MFCD03419286, AKOS006348056, AKOS027427031, ACN-048236, DS-3343, FT-0612892, C06231, (6S)-2-methyl-1,4,5,6-tetrahydropyrimidine-6-carboxylic acid, (S)-1,4,5,6-tetrahydro-2-methyl-4-pyrimi-dinecarboxylic acid, (s)-1,4,5,6-tetrahydro-2-methyl-4-pyrimidinecarboxylic acid, 4-Pyrimidinecarboxylic acid, 1,4,5,6-tetrahydro-2-methyl-, (+)-, 4-Pyrimidinecarboxylic acid, 1,4,5,6-tetrahydro-2-methyl-, (4S)-, Ectoine (2-Methyl-1,4,5,6-tetrahydropyrimidine-4-carboxylic acid), CID126041, NSC614616, 1,4,5,6-Tetrahydro-2-methyl-4-pyrimidinecarboxylic acid, (4S)-3,4,5,6-Tetrahydro-2-methyl-4-pyrimidinecarboxylic acid, 4-Pyrimidinecarboxylic acid, 1,4,5,6-tetrahydro-2-methyl-, (4S)- (9CI),

Complexity	177
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	142.074g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	142.158g/mol
Monoisotopic Mass	142.074g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	61.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number