AG0068TU

98276-57-4 | 2,4-Diaminobenzaldehyde

AG0068TU

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CAS Number	98276-57-4
Catalog Number	AG0068TU(AGN-PC-0NGO2P)
Chemical Name	2,4-Diaminobenzaldehyde
IUPAC Name	2,4-diaminobenzaldehyde
InChI	InChI=1S/C7H8N2O/c8-6-2-1-5(4-10)7(9)3-6/h1-4H,8-9H2
InChI Key	VMFJRVFZHAPENO-UHFFFAOYSA-N
MDL Number	MFCD02094162
Molecular Formula	C7H8N2O
Molecular Weight	136.1512
SMILES	O=CC1=CC=C(N)C=C1N
Synonyms	2,4-diaminobenzaldehyde, 98276-57-4, 2,4-diamino-benzaldehyde, AK136530, Benzaldehyde, 2,4-diamino-, SCHEMBL2334691, CTK5H9794, KS-00000ROB, DTXSID20456828, VMFJRVFZHAPENO-UHFFFAOYSA-N, ZINC2389514, 2,4-Diaminobenzaldehyde, AldrichCPR, FCH833061, MFCD02094162, AKOS006230138, ACN-052863, DS-5534, AJ-35597, AX8258098, CS-0039250, CID11147748, Benzaldehyde, 2,4-diamino- (6CI, 9CI),

Complexity	127
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	136.064g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	136.154g/mol
Monoisotopic Mass	136.064g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	69.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

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

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