AG0033VZ

770-31-0 | 4-Amino-2-(methylthio)pyrimidine-5-carbaldehyde

AG0033VZ

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CAS Number	770-31-0
Catalog Number	AG0033VZ(AGN-PC-0JPET2)
Chemical Name	4-Amino-2-(methylthio)pyrimidine-5-carbaldehyde
IUPAC Name	4-amino-2-methylsulfanylpyrimidine-5-carbaldehyde
InChI	InChI=1S/C6H7N3OS/c1-11-6-8-2-4(3-10)5(7)9-6/h2-3H,1H3,(H2,7,8,9)
InChI Key	FGONQMFYFJRAIG-UHFFFAOYSA-N
MDL Number	MFCD08669438
Molecular Formula	C6H7N3OS
Molecular Weight	169.2043
NSC Number	165376
SMILES	S(C)c1nc(N)c(cn1)C=O
Synonyms	4-amino-2-(methylthio)pyrimidine-5-carbaldehyde, 770-31-0, 4-amino-2-(methylsulfanyl)pyrimidine-5-carbaldehyde, 4-AMINO-2-(METHYLTHIO)-5-PYRIMIDINECARBOXALDEHYDE, 4-AMINO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXALDEHYDE, 4-amino-2-methylsulfanylpyrimidine-5-carbaldehyde, MFCD08669438, 4-AMINO-2-METHYLTHIO-PYRIMIDINE-5-CARBALDEHYDE, 5-PYRIMIDINECARBOXALDEHYDE, 4-AMINO-2-(METHYLTHIO)-, AK-32409, 4-amino-2-methylsulfanyl-pyrimidine-5-carbaldehyde, AN-584/43408172, 4-amino-2-methylsulfanyl-pyrimidine-5-carboxaldehyde, NSC165376, AC1L6OVP, AC1Q4H4Y, SCHEMBL1168107, CTK5E3746, DTXSID00304313, FGONQMFYFJRAIG-UHFFFAOYSA-N, RD-47, BCP03540, ZINC1644850, ANW-54860, FCH833022, QC-750, AKOS005266485, CA-2170, CHM0070390, CM14425, CS-W003536, NSC-165376, PB31299, TRA0028940, AC-29426, AJ-28662, AN-17316, AS-19262, CJ-05898, SC-69961, SY026667, AB0032705, AX8093724, DB-010246, ST1141007, TX-013148, 4CH-002085, AM20100762, FT-0084050, FT-0658386, X6099, A19156, M-7185, 4-Amino-2-methanethiopyrimidine-5-carboxaldehyde, MFCD08669438 (97+%), 4-amino-2-(methyl thio)pyrimidine-5-carbaldehyde, 4-amino-2-(methylsulfanyl)-5-pyrimidinecarbaldehyde, J-514307, S03-0007, 4-amino-2-(methyl sulfanyl)pyrimidine-5-carbaldehyde, 4-amino-2-(methylsulfanyl)-pyrimidine-5-carbaldehyde, C6H7N3OS, CID295769, ACN-028658,

Complexity	144
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	169.031g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	169.202g/mol
Monoisotopic Mass	169.031g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	94.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

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